Compound: Vitexin
SMILES: O=c1c2c(oc(c1)-c3ccc(O)cc3)c(c(O)cc2O)[C@@H]4O[C@@H]([C@@H](O)[C@@H]([C@H]4O)O)CO
InChIKey: SGEWCQFRYRRZDC-VPRICQMDSA-N
Synonyms: Vitexin, 3681-93-4, Apigenin 8-C-glucoside, 9VP70K75OK, DTXSID90190287, 5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one, CHEBI:16954, 4H-1-Benzopyran-4-one, 8-beta-D-glucopyranosyl-5,7-dihydroxy-2-(4-hydroxyphenyl)-, 8-glycosylapigenin, (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol, 8-glycosyl-apigenin, (1S)-1,5-anhydro-1-(5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl)-D-glucitol, 5,7-dihydroxy-2-(4-hydroxyphenyl)-8-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)chromen-4-one, RefChem:53003, DTXCID00112778, apigenin-8-c-beta-d-glucopyranoside, 222-963-8, Apigenin-8-C-glucoside, 8-beta-D-Glucopyranosyl-apigenin, 5,7-dihydroxy-2-(4-hydroxyphenyl)-8-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-4H-chromen-4-one, C21H20O10, MFCD00017456, ORIENTOSIDE, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-8-beta-D-glucopyranosyl-2-(4-hydroxyphenyl)-, 5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]chromen-4-one, Flavone, 8-D-glucosyl-4',5,7-trihydroxy-, 4H-1-Benzopyran-4-one, 8-.beta.-D-glucopyranosyl-5,7-dihydroxy-2-(4-hydroxyphenyl)-, EINECS 222-963-8, UNII-9VP70K75OK, Oritentoside, Vitx, SGEWCQFRYRRZDC-VPRICQMDSA-N, 8-glycosyl apigenin, Vitexin (Standard), VITEXINA, VITEXINE, 8-C-glucosyl apigenin, VITEXIN [USP-RS], VITEXIN [WHO-DD], Vitexin, analytical standard, 8-beta-D-Glucopyranosyl-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one, SCHEMBL25277, 8-C-b-D-Glucopyranosylapigenin, CHEMBL487417, orb1300221, orb3140388, SCHEMBL29572351, HY-N0013R, Apigenin 8-C-.beta.-D-glucoside, HY-N0013, apigenin 8-C-beta-D-glucopyranoside, BDBM50362886, HB4123, MSK158047, s9192, AKOS025311479, AC-6086, CCG-208516, EBC-457101, MV08032, NCGC00163642-01, Vitexin 100 microg/mL in Acetone:Water, 5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-4H-chromen-4-one, AS-55909, 8-D-Glucosyl-4',5',7'-trihydroxy-flavone, CS-0007090, NS00018314, APIGENIN-8-C-.BETA.-D-GLUCOPYRANOSIDE, C01460, Q259075, Vitexin, primary pharmaceutical reference standard, 5,7,4'-Trihydroxyflavone 8-C-.beta.-D-glucopyranoside, Vitexin, United States Pharmacopeia (USP) Reference Standard, FLAVONE, 8-.BETA.-D-GLUCOPYRANOSYL-4',5,7-TRIHYDROXY-, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-8-.beta.-D-glucopyranosyl-2-(4-hydroxyphenyl)-, (1S)-1,5-Anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-8-yl]-D-glucitol
Theoretical properties:
molecular_formula: C21H20O10
molecular_weight: 432.4 g/mol
exact_mass: 432.10564683 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 7
hydrogen_bond_acceptor_count: 10
rotatable_bond_count: 3
heavy_atom_count: 31
topological_polar_surface_area: 177 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: Vitexin is an apigenin flavone glycoside, which is found in the passion flower, bamboo leaves and pearl millet. It has a role as an antineoplastic agent, a platelet aggregation inhibitor, an EC 3.2.1.20 (alpha-glucosidase) inhibitor and a plant metabolite. It is a C-glycosyl compound and a trihydroxyflavone. It is functionally related to an apigenin. It is a conjugate acid of a vitexin-7-olate.
chebi: An apigenin flavone glycoside, which is found in the passion flower, bamboo leaves and pearl millet
chembl: VITEXIN is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Vitexin is an apigenin flavone glucoside, a chemical compound found in the passion flower, Vitex agnus-castus (chaste tree or chasteberry), in the Phyllostachys nigra bamboo leaves, in the pearl millet (Pennisetum millet), and in Hawthorn.