Compound: Afzelin
SMILES: O=c1c(O[C@@H]2O[C@H]([C@H](O)[C@H]([C@H]2O)O)C)c(oc3c1c(O)cc(c3)O)-c4ccc(O)cc4
InChIKey: SOSLMHZOJATCCP-AEIZVZFYSA-N
Synonyms: Afzelin, 482-39-3, Kaempferin, Kaempferol 3-rhamnoside, kaempferol-3-rhamnoside, Kaempferol 3-O-alpha-L-rhamnoside, kaempferol 3-O-alpha-L-rhamnopyranoside, 5M86W1YH7O, kaempherol 3-O-alpha-rhamnoside, CHEBI:80790, DTXSID50197459, 4H-1-Benzopyran-4-one, 3-((6-deoxy-alpha-L-mannopyranosyl)oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-, 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one, 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl)oxychromen-4-one, deacyl-SL0101, RefChem:110063, DTXCID10119950, 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-((2S,3S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl)oxychromen-4-one, Kaempferol rhamnoside, CHEMBL240528, KAEMPFEROL-3-O-RHAMNOSIDE, 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one, MFCD00210589, MFCD17676152, KAEMPFEROL 3-O-RHAMNOPYRANOSIDE, kaempferol-3-o-alpha-l-rhamnopyranoside, 5,7-Dihydroxy-2-(4-Hydroxyphenyl)-4-Oxo-4h-Chromen-3-Yl 6-Deoxy-Alpha-L-Mannopyranoside, 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-chromen-4-one, Kaempferol 3-O-?-L-Rhamnoside, Afzeloside, kaempferol-3-o-beta-rhamnoside, kaempferol-rhamnose, 4H-1-BENZOPYRAN-4-ONE, 3-((6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL)OXY)-5,7-DIHYDROXY-2-(4-HYDROXYPHENYL)-, 4H-1-Benzopyran-4-one, 3-[(6-deoxy-.alpha.-L-mannopyranosyl)oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-, Afzelin (Standard), kaempferol-rhamnoside, kaempferol-3-O-rhamnose, UNII-5M86W1YH7O, kaempferol-3-O-L-rhamnoside, kaempfern-3-O-alpha-rhamnoside, MEGxp0_000339, SCHEMBL1689477, SCHEMBL29366762, ACon1_000149, HY-N1441R, KAEMPFEROL 3-L-RHAMNOSIDE, WLZ4652, kaempferol-3-O-alpha-L-rahmnoside, 3-O-(alpha-L-rhamnosyl)kaempferol, Afzelin; Kaempferol-3-O-rhamnoside, HY-N1441, Afzelin, >=90% (LC/MS-UV), BDBM50213414, MSK158204, AKOS032962059, kaempferol 3-O-alpha-L-rhampyranoside, EBC-618475, FK72069, afzelin; kaempherol 3-O-alpha-rhamnoside, KAEMPFEROL-3-.ALPHA.-L-RHAMNOSE, NCGC00180834-03, 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-4H-chromen-4-one, SY231847, KAEMPHEROL 3-O-.ALPHA.-RHAMNOSIDE, CS-0016878, KAEMPFEROL 3-O-.ALPHA.-L-RHAMNOSIDE, NS00096994, 3-O-.ALPHA.-L-RHAMNOPYRANOSYLKAEMPFEROL, C16911, KAEMPFEROL 3-.ALPHA.-L-RHAMNOPYRANOSIDE, KAEMPFEROL 3-(6-DEOXY-L-MANNOPYRANOSIDE), KAEMPFEROL 3-O-.ALPHA.-L-RHAMNOPYRANOSIDE, KAEMPHEROL 3-O-.ALPHA.-L-RHAMNOPYRANOSIDE, Q3334749, 5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl alpha-L-rhamnoside, 3-((6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL)OXY)-5,7-DIHYDROXY-2-(4-HYDROXYPHENYL)-4H-1-BENZOPYRAN-4-ONE, 5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-3-yl 6-deoxy-alpha-L-mannopyranoside, 786711-07-7, AFE
Theoretical properties:
molecular_formula: C21H20O10
molecular_weight: 432.4 g/mol
exact_mass: 432.10564683 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 6
hydrogen_bond_acceptor_count: 10
rotatable_bond_count: 3
heavy_atom_count: 31
topological_polar_surface_area: 166 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: Afzelin is a glycosyloxyflavone that is kaempferol attached to an alpha-L-rhamnosyl residue at position 3 via a glycosidic linkage. It has a role as an antibacterial agent, an anti-inflammatory agent and a plant metabolite. It is a trihydroxyflavone, a glycosyloxyflavone and a monosaccharide derivative. It is functionally related to a kaempferol. It is a conjugate acid of an afzelin(1-).
chebi: A glycosyloxyflavone that is kaempferol attached to an α-<small>L</small>-rhamnosyl residue at position 3 via a glycosidic linkage.
chembl: AFZELIN is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Afzelin is a flavonol glycoside. It is the rhamnoside of kaempferol.  It is found in Nymphaea odorata.