Bioactive Compound Details

BioIDbio537
NameGENTISIDE C
ChEMBL IDCHEMBL1254184
Molecular FormulaC24H40O4
Molecular Weight392.58
Molecular Weight (Monoisotopic)392.2927
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsGentiside C
SmilesCC[C@H](C)CCCCCCCCCCCCCOC(=O)c1cccc(O)c1O
InchiInChI=1S/C24H40O4/c1-3-20(2)16-13-11-9-7-5-4-6-8-10-12-14-19-28-24(27)21-17-15-18-22(25)23(21)26/h15,17-18,20,25-26H,3-14,16,19H2,1-2H3/t20-/m0/s1
Inchi KeyXGXUFBAHOWHDNU-FQEVSTJZSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities7.0
Np Likeness Score0.43
Records Key['3']
Records Name['gentiside C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure