Compound: Visnagin
SMILES: O=c1c2c(OC)c3c(occ3)cc2oc(c1)C
InChIKey: NZVQLVGOZRELTG-UHFFFAOYSA-N
Synonyms: Visnagin, 82-57-5, Desmethoxykhellin, Visnagidin, Visnagine, 5-Methoxy-2-methylfuranochromone, 4-methoxy-7-methylfuro[3,2-g]chromen-5-one, P64438MLBW, DTXSID50231509, NSC-100593, 4-Methoxy-7-methylfuro(3,2-g)chromen-5-one, CHEBI:10002, 4-methoxy-7-methylpyrano(3,2-f)(1)benzoxol-5-one, 4-methoxy-7-methylpyrano[3,2-f][1]benzoxol-5-one, RefChem:901992, DTXCID30154000, 201-430-3, 4-Methoxy-7-methyl-5H-furo[3,2-g]chromen-5-one, 4-Methoxy-7-methyl-furo[3,2-g]chromen-5-one, 5H-Furo[3,2-g][1]benzopyran-5-one,4-methoxy-7-methyl-, MFCD00005008, CHEMBL45176, 4-Methoxy-7-methyl-5H-furo[3,2-g][1]benZopyran-5-one, 5H-Furo[3,2-g][1]benzopyran-5-one, 4-methoxy-7-methyl-, 5H-FURO(3,2-g)(1)BENZOPYRAN-5-ONE, 4-METHOXY-7-METHYL-, Desmethoxykhellin; NSC 100593; Visnagidin; Visnagine, 5-methoxy-2-methylfurano[3,2-g]chromen-4-one, SR-01000765669, EINECS 201-430-3, NSC 100593, BRN 0234955, UNII-P64438MLBW, 4-METHOXY-7-METHYL-5H-FURO(3,2-G)(1)BENZOPYRAN-5-ONE, 4-Methoxy-7-methyl-5H-furo(3,2-g)(1)-benzopyran-5-one, Spectrum_001227, SpecPlus_000453, VISNAGIN [MI], Spectrum2_001796, Spectrum3_001340, Spectrum4_001766, Spectrum5_000351, Oprea1_854963, BSPBio_003099, GTPL433, KBioGR_002251, KBioSS_001707, SPECTRUM310041, 5-19-06-00030 (Beilstein Handbook Reference), MLS000697721, DivK1c_006549, SCHEMBL498450, SPBio_001751, MEGxp0_000332, orb1299129, SCHEMBL31670263, KBio1_001493, KBio2_001707, KBio2_004275, KBio2_006843, KBio3_002319, NZVQLVGOZRELTG-UHFFFAOYSA-, FUK-724, GLXC-13536, HMS2268P15, HY-N1082, 5H-Furo[3, 4-methoxy-7-methyl-, BBL027492, BDBM50051349, CCG-38444, EBC-32021, LMPK13110003, NSC100593, SBB057568, STL372894, AKOS015955735, FV42573, SDCCGMLS-0066603.P001, NCGC00095626-01, NCGC00095626-02, NCGC00178297-01, SMR000112234, VS-08551, DB-056633, CS-0016370, NS00038213, ST50307139, C09049, G12046, EN300-6745554, L000822, Q7936365, SR-01000765669-3, SR-01000765669-4, 4-Methoxy-7-methyl-5H-furo[3,2-g]chromen-5-one #, BRD-K68995359-001-02-8, BRD-K68995359-001-06-9, 4-Methoxy-7-methyl-5H-furo[3,2-g]-1-benzopyran-5-one, InChI=1/C13H10O4/c1-7-5-9(14)12-11(17-7)6-10-8(3-4-16-10)13(12)15-2/h3-6H,1-2H3
Theoretical properties:
molecular_formula: C13H10O4
molecular_weight: 230.22 g/mol
exact_mass: 230.05790880 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 0
hydrogen_bond_acceptor_count: 4
rotatable_bond_count: 1
heavy_atom_count: 17
topological_polar_surface_area: 48.7 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: Visnagin is a furanochromone that is furo[3,2-g]chromen-5-one which is substituted at positions 4 and 7 by methoxy and methyl groups, respectively. Found in the toothpick-plant, Ammi visnaga. It has a role as an EC 1.1.1.37 (malate dehydrogenase) inhibitor, a vasodilator agent, an antihypertensive agent, a phytotoxin, an anti-inflammatory agent and a plant metabolite. It is a furanochromone, a polyketide and an aromatic ether. It is functionally related to a 5H-furo[3,2-g]chromen-5-one.
chebi: A furanochromone that is furo[3,2-<em>g</em>]chromen-5-one which is substituted at positions 4 and 7 by methoxy and methyl groups, respectively. Found in the toothpick-plant, <em>Ammi visnaga</em>.
chembl: VISNAGIN is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Visnagin is an organic chemical compound with the molecular formula C13H10O4 It is a furanochromone, a compound derivative of chromone (1,4-benzopyrone) and furan.