anonymous041/ChEBI-Augmented huggingface dataset:
The molecule CN(C)CCNc1ccc2c3nc4ccccc4n3c(=O)c3cccc1c23 CN(C)CCNc1ccc2c3nc4ccccc4n3c(=O)c3cccc1c23 is DND-153 dye. It has the role of fluorochrome . It is also related to or classified as organic heteropentacyclic compound .
The molecule COC1=CC(=CC(OC)=C1OC)C(=O)OCCCN1CCCN(CCCOC(=O)C2=CC(OC)=C(OC)C(OC)=C2)CC1 COC1=CC(=CC(OC)=C1OC)C(=O)OCCCN1CCCN(CCCOC(=O)C2=CC(OC)=C(OC)C(OC)=C2)CC1 is A member of the class of diazepanes that is 1,4-diazepane substituted by 3-[(3,4,5-trimethoxybenzoyl)oxy]propyl groups at positions 1 and 4. It is a potent adenosine uptake inhibitor that exhibits antiplatelet, antianginal and vasodilator properties. It has the role of vasodilator agent . It has the role of platelet aggregation inhibitor . It has the role of cardioprotective agent .   It is also related to or classified as diester  . It is also related to or classified as benzoate ester , diazepane , methoxybenzenes .
The molecule CCC(=O)N1C[C@H]2[C@H]([C@H](N2C(=O)C1)CO)C3=CC=C(C=C3)C4=CC=C(C=C4)C#N CCC(=O)N1C[C@H]2[C@H]([C@H](N2C(=O)C1)CO)C3=CC=C(C=C3)C4=CC=C(C=C4)C#N is 4-[4-[(6R,7R,8S)-8-(hydroxymethyl)-2-oxo-4-(1-oxopropyl)-1,4-diazabicyclo[4.2.0]octan-7-yl]phenyl]benzonitrile. It is also related to or classified as nitrile  . It is also related to or classified as biphenyls .
The molecule C[C@@H]1CCCCO[C@@H]([C@H](CN(C(=O)C2=C(O1)C=CC(=C2)NC(=O)C3=CC=NC=C3)[C@H](C)CO)C)CNC C[C@@H]1CCCCO[C@@H]([C@H](CN(C(=O)C2=C(O1)C=CC(=C2)NC(=O)C3=CC=NC=C3)[C@H](C)CO)C)CNC is N-[(3R,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide. It is also related to or classified as lactam  . It is also related to or classified as azamacrocycle .
The molecule [C@@H]1(C=C[C@@H](CC1)CC(=O)C(=O)[O-])O [C@@H]1(C=C[C@@H](CC1)CC(=O)C(=O)[O-])O is A tetrahydro-4-hydroxyphenylpyruvate obtained by deprotonation of the carboxy group of 3-[(1S,4R)-4-hydroxycyclohex-2-en-1-yl]pyruvic acid; major species at pH 7.3. It is also related to or classified as tetrahydro-4-hydroxyphenylpyruvate  .
The molecule C[C@@H]1CCCCO[C@@H]([C@H](CN(C(=O)C2=C(O1)C=CC(=C2)NC(=O)C3=CC=NC=C3)[C@@H](C)CO)C)CN(C)C(=O)NC4=CC=CC5=CC=CC=C54 C[C@@H]1CCCCO[C@@H]([C@H](CN(C(=O)C2=C(O1)C=CC(=C2)NC(=O)C3=CC=NC=C3)[C@@H](C)CO)C)CN(C)C(=O)NC4=CC=CC5=CC=CC=C54 is N-[(3R,9S,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-pyridinecarboxamide. It is also related to or classified as lactam  . It is also related to or classified as azamacrocycle .
The molecule Cl.CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)[C@@H](O)CNC(C)(C)C Cl.CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)[C@@H](O)CNC(C)(C)C is the hydrochloride salt of (R)-bambuterol. It is also related to or classified as bambuterol hydrochloride  .
The molecule O=C1C2=C([C@@H]3O[C@H]([C@H]2[C@H]4[C@@H](OC=C5[C@@]34C(=O)C6O[C@@H]6[C@H]5O)C)C)[C@H](O)[C@@H]7[C@H]1O7 O=C1C2=C([C@@H]3O[C@H]([C@H]2[C@H]4[C@@H](OC=C5[C@@]34C(=O)C6O[C@@H]6[C@H]5O)C)C)[C@H](O)[C@@H]7[C@H]1O7 is Epoxyquinol A. It is also related to or classified as organic heterotricyclic compound , organooxygen compound .
The molecule C[C@H]1CCC[C@@H](O1)CC2CC3=C(C(=CC(=C3)O)O)C(=O)O2 is a member of the class of isocoumarins that is 6,8-dihydroxy-3,4-dihydro-1H-isochromen-1-one substituted by a [6-methyltetrahydro-2H-pyran-2-yl]methyl group at position 3. It has been isolated from the fungus Chaetomium globosum and Aspergillus flavus. It has a role as an antifungal agent, an antiplasmodial drug, an Aspergillus metabolite and a Chaetomium metabolite. It is a member of isocoumarins, a member of pyrans and a member of resorcinols.
The molecule O([C@@H]1[C@@H](O[C@H]2[C@@H](O)[C@H](O)[C@H](O[C@@H]2O[C@H]3[C@@H](O)[C@H](O)[C@H](OC3O)CO)CO)O[C@@H]([C@@H](O)[C@@H]1O)CO)[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@@H]4O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@@H]5O[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@@H]6O)CO)CO)CO O([C@@H]1[C@@H](O[C@H]2[C@@H](O)[C@H](O)[C@H](O[C@@H]2O[C@H]3[C@@H](O)[C@H](O)[C@H](OC3O)CO)CO)O[C@@H]([C@@H](O)[C@@H]1O)CO)[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@@H]4O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@@H]5O[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@@H]6O)CO)CO)CO is A mannohexaose consisting of three beta-D-mannopyranosyl residues, two alpha-D-mannopyranosyl residues and a D-mannopyransyl residue joined in sequence by (1->2) glycosidic linkages. It is also related to or classified as mannohexaose .
The molecule O(C[C@H]1O[C@@H](N2C=3N=C(NC(C3N=C2)=O)N)[C@@H]([C@@H]1OP(OC[C@H]4O[C@@H](N5C6=NC=NC(=C6N=C5)N)[C@@H]([C@@H]4OP(OC[C@H]7O[C@@H](N8C(N=C(C=C8)N)=O)[C@@H]([C@@H]7OP(OC[C@H]9O[C@@H](N%10C(N=C(C=C%10)N)=O)[C@@H]([C@@H]9OP(OC[C@H]%11O[C@@H](N%12C(N=C(C=C%12)N)=O)[C@@H]([C@@H]%11O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)P(=O)(O)O[C@@H]%13[C@H](O[C@@H](N%14C(NC(C=C%14)=O)=O)[C@@H]%13O)COP(=O)(O)O[C@@H]%15[C@H](O[C@@H](N%16C=%17N=C(NC(C%17N=C%16)=O)N)[C@@H]%15O)CO O(C[C@H]1O[C@@H](N2C=3N=C(NC(C3N=C2)=O)N)[C@@H]([C@@H]1OP(OC[C@H]4O[C@@H](N5C6=NC=NC(=C6N=C5)N)[C@@H]([C@@H]4OP(OC[C@H]7O[C@@H](N8C(N=C(C=C8)N)=O)[C@@H]([C@@H]7OP(OC[C@H]9O[C@@H](N%10C(N=C(C=C%10)N)=O)[C@@H]([C@@H]9OP(OC[C@H]%11O[C@@H](N%12C(N=C(C=C%12)N)=O)[C@@H]([C@@H]%11O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)P(=O)(O)O[C@@H]%13[C@H](O[C@@H](N%14C(NC(C=C%14)=O)=O)[C@@H]%13O)COP(=O)(O)O[C@@H]%15[C@H](O[C@@H](N%16C=%17N=C(NC(C%17N=C%16)=O)N)[C@@H]%15O)CO is an RNA fragment comprised of two guanosine, one uridine, one adenosine and three cytidine residues connected by 3'->5' phosphodiester linkages in the sequence G-U-G-A-C-C-C. It is also related to or classified as RNA fragment .
The molecule CCCCC[C@@H](/C=C/[C@H]1C=CC(=O)[C@@H]1CCCCCCC(=O)[O-])O is conjugate base of prostaglandin A1. It has a role as a human metabolite. It is a conjugate base of a prostaglandin A1.
The molecule O=C1C2=C(O)C(=CC=C2C(=O)[C@@]34[C@@]1(O)[C@H](O[C@@H](C3)CC(O4)=O)C)[C@@H]5O[C@@H]([C@@H](O)C(C5)N(C)C)C O=C1C2=C(O)C(=CC=C2C(=O)[C@@]34[C@@]1(O)[C@H](O[C@@H](C3)CC(O4)=O)C)[C@@H]5O[C@@H]([C@@H](O)C(C5)N(C)C)C is MDN-0171. It is also related to or classified as organic heterotricyclic compound , organooxygen compound .
The molecule CCN\\1C2=CC=CC=C2O/C1=C\\C=C\\C=C\\C3=[N+](C4=CC=CC=C4O3)CC.[I-] is a cyanine dye, an organic iodide salt and a member of 1,3-benzoxazoles. It has a role as a fluorochrome. It contains a C5-oxacyanine cation.
The molecule C[C@]12CC[C@H](C1(C)C)C[C@H]2OC(=O)C3=CC(=CC(=C3)OC)OC is a benzoate ester resulting from the formal condensation of the carboxy group of 3,5-dimethoxybenzoic acid with the hydroxy group of (-)-borneol. It is a dimethoxybenzene, a benzoate ester, a monoterpenoid and a carbobicyclic compound. It derives from a (-)-borneol and a 3,5-dimethoxybenzoic acid.
The molecule O1C(C(O)C(O)C(O)C1OC2=C(OC=3C(C2=O)=C(O)C=C(O)C3)C4=CC=C(OC5OCC(O)C(O)C5O)C=C4)C O1C(C(O)C(O)C(O)C1OC2=C(OC=3C(C2=O)=C(O)C=C(O)C3)C4=CC=C(OC5OCC(O)C(O)C5O)C=C4)C is Kaempferol 3-rhamnoside 4'-xyloside. It is also related to or classified as glycoside  . It is also related to or classified as flavonoids .
The molecule CCCCC\C=C/CC1OC1CCCCCCCC(O)=O CCCCC\C=C/CC1OC1CCCCCCCC(O)=O is an EpOME obtained by formal epoxidation of the 9,10-double bond of octadeca-9,12-dienoic acid (the 12Z-geoisomer). It is a conjugate acid of 9(10)-EpOME(1-) . It is also related to or classified as epoxyoctadecenoic acid .
The molecule C(C[NH3+])CCNCCC(O)=O C(C[NH3+])CCNCCC(O)=O is Putreanine. Its functional parent is beta-amino acid . It is also related to or classified as organonitrogen compound , organooxygen compound .
The molecule [C@@H]1(C=C[C@H](CC1)CC(=O)C(=O)[O-])O [C@@H]1(C=C[C@H](CC1)CC(=O)C(=O)[O-])O is A tetrahydro-4-hydroxyphenylpyruvate obtained by deprotonation of the carboxy group of 3-[(1R,4R)-4-hydroxycyclohex-2-en-1-yl]pyruvic acid; major species at pH 7.3. It is also related to or classified as tetrahydro-4-hydroxyphenylpyruvate  .
The molecule C[C@H]1CCCCO[C@H]([C@@H](CN(C(=O)C2=C(O1)C=CC(=C2)N(C)C)[C@H](C)CO)C)CN(C)S(=O)(=O)C3=CN(C=N3)C C[C@H]1CCCCO[C@H]([C@@H](CN(C(=O)C2=C(O1)C=CC(=C2)N(C)C)[C@H](C)CO)C)CN(C)S(=O)(=O)C3=CN(C=N3)C is N-[[(3S,9R,10R)-16-(dimethylamino)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide. It is also related to or classified as lactam  . It is also related to or classified as azamacrocycle .
The molecule C/C(=C\\C(=O)N(C)C)/OP(=O)(OC)OC is a dialkyl phosphate and an organophosphate insecticide. It has a role as an EC 3.1.1.7 (acetylcholinesterase) inhibitor, an acaricide, an avicide and an agrochemical.
The molecule O=C(O)/C(=C/C=C/C=C/C=C/C=C/CC/C=C/C(C(O)C(C(O)/C=C/C=C/C=C/C=C/C=C/CC(O)C(C(=O)CC(O)CC(O)CC(O)/C=C/CC(O)CC(O)CC(O)CC(O)/C=C/CC(O)/C=C/CC(O)CC(O)CCCN)C)C)C)/C O=C(O)/C(=C/C=C/C=C/C=C/C=C/CC/C=C/C(C(O)C(C(O)/C=C/C=C/C=C/C=C/C=C/CC(O)C(C(=O)CC(O)CC(O)CC(O)/C=C/CC(O)CC(O)CC(O)CC(O)/C=C/CC(O)/C=C/CC(O)CC(O)CCCN)C)C)C)/C is Linearmycin B. It is also related to or classified as very long-chain fatty acid  .
The molecule C(C[NH3+])OP(=O)([O-])OC[C@H](OC(CCC/C=C\C/C=C\C/C=C\C=C\C(CCCCC)O)=O)COC(=O)CCCCCCCCCCCCCCCCC C(C[NH3+])OP(=O)([O-])OC[C@H](OC(CCC/C=C\C/C=C\C/C=C\C=C\C(CCCCC)O)=O)COC(=O)CCCCCCCCCCCCCCCCC is an oxidized phosphatidylethanolamine 38:4 zwitterion obtained by transfer of a proton from the phosphate to the amino group of 1-octadecanoyl-2-(15-hydroxy-(5Z,8Z,11Z,13E)-eicosatetraenoyl)-sn-glycero-3-phosphoethanolamine. It is also related to or classified as organic molecular entity .
The molecule O(C[C@H]1O[C@@H](N2C=3N=C(NC(C3N=C2)=O)N)[C@@H]([C@@H]1OP(OC[C@H]4O[C@@H](N5C6=NC=NC(=C6N=C5)N)[C@@H]([C@@H]4OP(OC[C@H]7O[C@@H](N8C=9N=C(NC(C9N=C8)=O)N)[C@@H]([C@@H]7OP(OC[C@H]%10O[C@@H](N%11C%12=NC=NC(=C%12N=C%11)N)[C@@H]([C@@H]%10OP(OC[C@H]%13O[C@@H](N%14C(N=C(C=C%14)N)=O)[C@@H]([C@@H]%13OP(OC[C@H]%15O[C@@H](N%16C(N=C(C=C%16)N)=O)[C@@H]([C@@H]%15OP(OC[C@H]%17O[C@@H](N%18C(N=C(C=C%18)N)=O)[C@@H]([C@@H]%17OP(OC[C@H]%19O[C@@H](N%20C%21=NC=NC(=C%21N=C%20)N)[C@@H]([C@@H]%19OP(OC[C@H]%22O[C@@H](N%23C(N=C(C=C%23)N)=O)[C@@H]([C@@H]%22O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)P(=O)(O)O[C@@H]%24[C@H](O[C@@H](N%25C%26=NC=NC(=C%26N=C%25)N)[C@@H]%24O)COP(=O)(O)O[C@@H]%27[C@H](O[C@@H](N%28C=%29N=C(NC(C%29N=C%28)=O)N)[C@@H]%27O)CO O(C[C@H]1O[C@@H](N2C=3N=C(NC(C3N=C2)=O)N)[C@@H]([C@@H]1OP(OC[C@H]4O[C@@H](N5C6=NC=NC(=C6N=C5)N)[C@@H]([C@@H]4OP(OC[C@H]7O[C@@H](N8C=9N=C(NC(C9N=C8)=O)N)[C@@H]([C@@H]7OP(OC[C@H]%10O[C@@H](N%11C%12=NC=NC(=C%12N=C%11)N)[C@@H]([C@@H]%10OP(OC[C@H]%13O[C@@H](N%14C(N=C(C=C%14)N)=O)[C@@H]([C@@H]%13OP(OC[C@H]%15O[C@@H](N%16C(N=C(C=C%16)N)=O)[C@@H]([C@@H]%15OP(OC[C@H]%17O[C@@H](N%18C(N=C(C=C%18)N)=O)[C@@H]([C@@H]%17OP(OC[C@H]%19O[C@@H](N%20C%21=NC=NC(=C%21N=C%20)N)[C@@H]([C@@H]%19OP(OC[C@H]%22O[C@@H](N%23C(N=C(C=C%23)N)=O)[C@@H]([C@@H]%22O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)P(=O)(O)O[C@@H]%24[C@H](O[C@@H](N%25C%26=NC=NC(=C%26N=C%25)N)[C@@H]%24O)COP(=O)(O)O[C@@H]%27[C@H](O[C@@H](N%28C=%29N=C(NC(C%29N=C%28)=O)N)[C@@H]%27O)CO is an RNA fragment comprised of three guanosine, two adenosine and four cytidine residues connected by 3'->5' phosphodiester linkages in the sequence G-A-G-A-G-A-C-C-C-A-C. It is also related to or classified as RNA fragment .
The molecule CCCCCCCCCCCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCC/C=C\\CCCCCCCC is a 1,2-diacyl-sn-glycerol where oleoyl and myristoyl are the 1- and 2-acyl groups respectively. It is a 1,2-diacyl-sn-glycerol and a tetradecanoate ester. It derives from an oleic acid.
The molecule CCCCC[C@H](O)\C=C\[C@@H]1[C@@H](C\C=C/CCCC(O)=O)[C@@H](O)CC1=O CCCCC[C@H](O)\C=C\[C@@H]1[C@@H](C\C=C/CCCC(O)=O)[C@@H](O)CC1=O is A member of the class of  prostaglandins D that is prosta-5,13-dien-1-oic acid substituted by hydroxy groups at positions 9 and 15 and an oxo group at position 11 (the 5Z,9alpha,13E,15S- stereoisomer). It has the role of mouse metabolite . It has the role of human metabolite . It is a conjugate acid of prostaglandin D2(1-) . It is also related to or classified as prostaglandins D  .
The molecule C(CCC(=O)[O-])CCN is an amino-acid anion that is the conjugate base of 6-aminohexanoic acid. It derives from a hexanoate. It is a conjugate base of a 6-aminohexanoic acid zwitterion and a 6-aminohexanoic acid.
The molecule [H][C@]12C[C@@H](O)[C@H](\C=C\C(=O)CCCCC)[C@@]1([H])C\C(O2)=C\CCCC(O)=O [H][C@]12C[C@@H](O)[C@H](\C=C\C(=O)CCCCC)[C@@]1([H])C\C(O2)=C\CCCC(O)=O is 15-dehydro-prostaglandin I2. Its functional parent is prostaglandin I2 . It is a conjugate acid of 15-dehydro-prostaglandin I2(1-) . It is also related to or classified as prostaglandins I  .
The molecule [C@@H]1(C=C/C(/CC1)=C\C(=O)C(=O)[O-])O [C@@H]1(C=C/C(/CC1)=C\C(=O)C(=O)[O-])O is A 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvate obtained by deprotonation of the carboxy group of 3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvic acid; major species at pH 7.3. It is also related to or classified as 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvate  .
The molecule O=C1C(C(=O)N)=CNC(=C1)/C=C\CCCCCCCCC(=O)O O=C1C(C(=O)N)=CNC(=C1)/C=C\CCCCCCCCC(=O)O is Himeic acid F. It is also related to or classified as long-chain fatty acid  .
The molecule O=C1NC(=O)C(C=N1)=N#N O=C1NC(=O)C(C=N1)=N#N is 5-diazouracil. Its functional parent is uracil . It is also related to or classified as diazo compound .
The molecule C[C@@H]1CCCCO[C@@H]([C@@H](CN(C(=O)C2=C(O1)C=CC(=C2)NS(=O)(=O)C)[C@@H](C)CO)C)CN(C)CC3CCCCC3 C[C@@H]1CCCCO[C@@H]([C@@H](CN(C(=O)C2=C(O1)C=CC(=C2)NS(=O)(=O)C)[C@@H](C)CO)C)CN(C)CC3CCCCC3 is N-[(3R,9S,10R)-9-[[cyclohexylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]methanesulfonamide. It is also related to or classified as lactam  . It is also related to or classified as azamacrocycle .
The molecule CCCCCCCC/C=C\\CCCCCCCC(=O)OCC(COP(=O)(O)O)OC(=O)CCCCCCC/C=C\\CCCCCCCC is a phosphatidic acid in which the phosphatidyl acyl groups are both oleoyl. It is a conjugate acid of a dioleoylphosphatidate(2-).
The molecule CC(=O)NCCCCC(O)=O CC(=O)NCCCCC(O)=O is A member of the class of  acetamides that is the acetyl derivative of 5-aminopentanoic acid. It has the role of metabolite . Its functional parent is 5-aminopentanoic acid . It is a conjugate acid of 5-acetamidopentanoate . It is also related to or classified as acetamides .
The molecule O([C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)OCCCC=2C=CC(=CC2)OC)O)O)C[C@@H]([C@@H]([C@@H](CCCCCCCCCCCCCC)O)O)NC(CCCCCCCCCCCCCCCCCCCCCCCCC)=O O([C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)OCCCC=2C=CC(=CC2)OC)O)O)C[C@@H]([C@@H]([C@@H](CCCCCCCCCCCCCC)O)O)NC(CCCCCCCCCCCCCCCCCCCCCCCCC)=O is A glycophytoceramide having a 4-O-[3-(4-methoxyphenyl)propyl]-alpha-D-galactosyl residue at the O-1 position and a hexacosanoyl group attached to the nitrogen. One of a series of an extensive set of 4"-O-alkylated alpha-GalCer analogues evaluated (PMID:30556652) as invariant natural killer T-cell (iNKT) antigens. Its functional parent is alpha-D-galactose . It is also related to or classified as glycophytoceramide .
The molecule C[C@H]1[C@@H](C[C@H]([C@@H](O1)OCCCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O)O)O)O)O is an acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of oscr#32. It derives from an oscr#32. It is a conjugate acid of an oscr#32-CoA(4-).
The molecule CC1=CC=C(C=C1NC(=O)C1=CC(NC(=O)NC2=CC=CC(=C2)C(=O)NC2=CC(=CC=C2C)C(=O)NC2=CC=C(C3=CC(=CC(=C23)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O)=CC=C1)C(=O)NC1=CC=C(C2=CC(=CC(=C12)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O CC1=CC=C(C=C1NC(=O)C1=CC(NC(=O)NC2=CC=CC(=C2)C(=O)NC2=CC(=CC=C2C)C(=O)NC2=CC=C(C3=CC(=CC(=C23)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O)=CC=C1)C(=O)NC1=CC=C(C2=CC(=CC(=C12)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O is an organosulfate oxoanion that is the hexanion of suramin resulting from the deprotonation of the six sulfo groups; major species at pH 7.3. It is also related to or classified as organosulfate oxoanion  .
The molecule OC[C@H]1O[C@@H](N2C=3N=C(NC(C3N=C2)=O)N)[C@@H]([C@@H]1OP(OC[C@H]4O[C@@H](N5C6=NC=NC(=C6N=C5)N)[C@@H]([C@@H]4OP(OC[C@H]7O[C@@H](N8C=9N=C(NC(C9N=C8)=O)N)[C@@H]([C@@H]7OP(OC[C@H]%10O[C@@H](N%11C%12=NC=NC(=C%12N=C%11)N)[C@@H]([C@@H]%10OP(OC[C@H]%13O[C@@H](N%14C(N=C(C=C%14)N)=O)[C@@H]([C@@H]%13OP(OC[C@H]%15O[C@@H](N%16C(N=C(C=C%16)N)=O)[C@@H]([C@@H]%15OP(OC[C@H]%17O[C@@H](N%18C(N=C(C=C%18)N)=O)[C@@H]([C@@H]%17O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O OC[C@H]1O[C@@H](N2C=3N=C(NC(C3N=C2)=O)N)[C@@H]([C@@H]1OP(OC[C@H]4O[C@@H](N5C6=NC=NC(=C6N=C5)N)[C@@H]([C@@H]4OP(OC[C@H]7O[C@@H](N8C=9N=C(NC(C9N=C8)=O)N)[C@@H]([C@@H]7OP(OC[C@H]%10O[C@@H](N%11C%12=NC=NC(=C%12N=C%11)N)[C@@H]([C@@H]%10OP(OC[C@H]%13O[C@@H](N%14C(N=C(C=C%14)N)=O)[C@@H]([C@@H]%13OP(OC[C@H]%15O[C@@H](N%16C(N=C(C=C%16)N)=O)[C@@H]([C@@H]%15OP(OC[C@H]%17O[C@@H](N%18C(N=C(C=C%18)N)=O)[C@@H]([C@@H]%17O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O)(=O)O)O is an RNA fragment comprised of two guanosine, two adenosine and three cytidine residues connected by 3'->5' phosphodiester linkages in the sequence G-A-G-A-C-C-C. It is also related to or classified as RNA fragment .
The molecule C1[C@H](C(=O)N[C@@H]1COC2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N)CC(=O)O is a pyrrolidinone that is pyrrolidin-2-one which is substituted at positions 3 and 5 by carboxymethyl and hydroxymethyl groups, respectively, and in which the hydrogen of the resulting alcoholic hydroxy group is replaced by a 4'-carbamimidoylbiphenyl-4-yl group (the S,S-diastereoisomer). A figrinogen receptor antagonist. It has a role as a platelet glycoprotein-IIb/IIIa receptor antagonist. It is a monocarboxylic acid, a carboxamidine and a member of pyrrolidin-2-ones.
The molecule CN[C@H]1[C@H](O)[C@@H](O)[C@H](CO)O[C@H]1O[C@H]1[C@@H](O[C@@H](CO)[C@]1(O)C=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](NC(N)=N)[C@@H](O)[C@@H]1NC(N)=N CN[C@H]1[C@H](O)[C@@H](O)[C@H](CO)O[C@H]1O[C@H]1[C@@H](O[C@@H](CO)[C@]1(O)C=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](NC(N)=N)[C@@H](O)[C@@H]1NC(N)=N is A streptomycin bearing an additional hydroxy substituent at the 5'-position (on the furanose ring). Its functional parent is streptomycin . It is also related to or classified as streptomycins .
The molecule IC1=CC(C[C@H]([NH3+])C([O-])=O)=CC(I)=C1OC2=CC=C(O)C=C2 IC1=CC(C[C@H]([NH3+])C([O-])=O)=CC(I)=C1OC2=CC=C(O)C=C2 is major microspecies at pH 7.3. It is also related to or classified as L-alpha-amino acid zwitterion  . It is also related to or classified as 3,5-Diiodothyronine  .
The molecule [123Sb] is the stable isotope of antimony with relative atomic mass 122.904216, 42.8 atom percent natural abundance and nuclear spin 7/2. It is an antimony(0) and an antimony atom.
The molecule CCC(C)[C@H]1O[C@@]2(C[C@@H]3C[C@@H](C\C=C(C)\[C@@H](O)[C@@H](C)\C=C\C=C4/CO[C@@H]5[C@H](O)C(C)=C[C@@H](C(=O)O3)[C@]45O)O2)C[C@H](O)[C@@H]1C CCC(C)[C@H]1O[C@@]2(C[C@@H]3C[C@@H](C\C=C(C)\[C@@H](O)[C@@H](C)\C=C\C=C4/CO[C@@H]5[C@H](O)C(C)=C[C@@H](C(=O)O3)[C@]45O)O2)C[C@H](O)[C@@H]1C is Avermectin B2a aglycone. It is also related to or classified as secondary allylic alcohol  . It is also related to or classified as tertiary allylic alcohol  . It is also related to or classified as macrocyclic lactone , spiroketal .
The molecule OC12COC(C=3C=C4OC(COC)C(OC4=CC3OC)C5=CC=C6OCOC6=C5)C2COC1OC7=C(OC)C=C8OCOC8=C7OC OC12COC(C=3C=C4OC(COC)C(OC4=CC3OC)C5=CC=C6OCOC6=C5)C2COC1OC7=C(OC)C=C8OCOC8=C7OC is haedoxan A. It has the role of insecticide . It is also related to or classified as organic molecular entity .
The molecule [C@@H]1([C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(O)=O)O[C@@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O)O)O)O)O[C@H]5[C@@H]([C@H]([C@H](O[C@@H]5CO)O[C@@H]6[C@@H]([C@H]([C@H](O[C@@H]6CO)OCCN)O)O)O)O [C@@H]1([C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(O)=O)O[C@@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O)O)O)O)O[C@H]5[C@@H]([C@H]([C@H](O[C@@H]5CO)O[C@@H]6[C@@H]([C@H]([C@H](O[C@@H]6CO)OCCN)O)O)O)O is an alpha-D-glucoside that is the 2-aminoethyl glycoside of a hexasaccharide consisting of alpha-D-glucosyl, alpha-D-galactosyl, beta-D-glucuronosyl, beta-D-glucosyl, alpha-D-glucosyl and alpha-D-galactosyl residues, all linked sequentially (1->4). It is also related to or classified as alpha-D-galactoside  . It is also related to or classified as hexasaccharide derivative .
The molecule C(C[NH3+])CC[NH2+]CCC([O-])=O C(C[NH3+])CC[NH2+]CCC([O-])=O is major microspecies at pH 7.3.  It is also related to or classified as carboxylic acid anion  . It is also related to or classified as N-substituted putrescine .
The molecule C[C@@H]1CN([C@H](COC2=C(C=CC(=C2)NC(=O)C)C(=O)N(C[C@H]1OC)C)C)C(=O)C3=CC=CC=C3F C[C@@H]1CN([C@H](COC2=C(C=CC(=C2)NC(=O)C)C(=O)N(C[C@H]1OC)C)C)C(=O)C3=CC=CC=C3F is N-[(5S,6R,9S)-8-[(2-fluorophenyl)-oxomethyl]-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]acetamide. It is also related to or classified as lactam  . It is also related to or classified as azamacrocycle .
The molecule C[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)O)NC(=O)C)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)NC(=O)C)O)O)O is an amino trisaccharide that is 2-acetamido-2-deoxy-beta-D-glucopyranose in which the hydroxy groups at positions 4 and 6 have been converted into the corresponding 2-acetamido-2-deoxy-beta-D-glucopyranosyl and beta-L-fucopyranosyl derivatives, respectively. It is a member of acetamides, an amino trisaccharide and a glucosamine oligosaccharide. It derives from a N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-beta-D-glucosamine.
The molecule O=C(OC)/C=C/C(=C/C(C(O)C1=C(O)C(NC(=O)C)=CC(=C1)O)C)/C O=C(OC)/C=C/C(=C/C(C(O)C1=C(O)C(NC(=O)C)=CC(=C1)O)C)/C is NFAT-68. It is also related to or classified as anilide  . It is also related to or classified as acetamides .
The molecule C(CNC(=S)N)C(=O)O C(CNC(=S)N)C(=O)O is 3-thioureidopropionic acid. Its functional parent is beta-amino acid . It is also related to or classified as organonitrogen compound , organooxygen compound .
The molecule C(CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)N is a beta-D-glucoside that is the 2-aminoethyl glycoside of a disaccharide consisting of beta-D-glucosyl and beta-D-glucuronosyl residues linked (1->4). It is a beta-D-glucoside and a disaccharide derivative.
The molecule [H][C@]1(CCN(CCc2ccc3OCCc3c2)C1)C(C(N)=O)(c1ccccc1)c1ccccc1 [H][C@]1(CCN(CCc2ccc3OCCc3c2)C1)C(C(N)=O)(c1ccccc1)c1ccccc1 is 2-[(3S)-1-Ethylpyrrolidin-3-yl]-2,2-diphenylacetamide in which one of the hydrogens at the 2-position of the ethyl group is substituted by a  2,3-dihydro-1-benzofuran-5-yl group. It is a selective antagonist for the M3 muscarinic acetylcholine receptor, which is primarily responsible for bladder muscle contractions, and is used as the hydrobromide salt in the management of urinary incontinence. It has the role of muscarinic antagonist . It has the role of antispasmodic drug . It is also related to or classified as monocarboxylic acid amide  . It is also related to or classified as pyrrolidines , 1-benzofurans .
The molecule O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC2=CC(=CC(O)=C2)/C=C/C3=CC=C(O)C=C3)C(O)=O O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC2=CC(=CC(O)=C2)/C=C/C3=CC=C(O)C=C3)C(O)=O is trans-Resveratrol 3-O-glucuronide. It is also related to or classified as glycoside  . It is also related to or classified as stilbenoid .