Bioactive Compound Details

BioIDbio1700
NameNone
ChEMBL IDCHEMBL1209088
Molecular FormulaC21H20O10
Molecular Weight432.38
Molecular Weight (Monoisotopic)432.1056
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsGenistein 6-C-Glucoside
SmilesO=c1c(-c2ccc(O)cc2)coc2cc(O)c([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c(O)c12
InchiInChI=1S/C21H20O10/c22-6-13-17(26)19(28)20(29)21(31-13)14-11(24)5-12-15(18(14)27)16(25)10(7-30-12)8-1-3-9(23)4-2-8/h1-5,7,13,17,19-24,26-29H,6H2/t13-,17-,19+,20-,21+/m0/s1
Inchi KeyATZZRHLIRRPCRD-ZNJKIUPRSA-N
Molecular SpeciesACID
Targets1.0
Bioactivities1.0
Np Likeness Score1.99
Records Key['10']
Records Name['genistein 6-C-glucoside']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure