Bioactive Compound Details

BioIDbio1115
NameGRAMNIPHENOL C
ChEMBL IDCHEMBL2333777
Molecular FormulaC20H20O6
Molecular Weight356.37
Molecular Weight (Monoisotopic)356.126
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsGramniphenol C
SmilesCOc1ccc2c(c1)C=C[C@@H](c1ccc(O)c(C(=O)CCO)c1OC)O2
InchiInChI=1S/C20H20O6/c1-24-13-4-8-17-12(11-13)3-7-18(26-17)14-5-6-15(22)19(20(14)25-2)16(23)9-10-21/h3-8,11,18,21-22H,9-10H2,1-2H3/t18-/m0/s1
Inchi KeyFJRLGZIVEMDILD-SFHVURJKSA-N
Molecular SpeciesNEUTRAL
Targets4.0
Bioactivities6.0
Np Likeness Score1.45
Records Key['1, Gramniphenol C']
Records Name['(S)-3-Hydroxy-1-[6-hydroxy-2-methoxy-3-(6-methoxy-2H-chromen-2-yl)phenyl]propan-1-one']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure