Bioactive Compound Details

BioIDbio455
NameOCOPHYLOL C
ChEMBL IDCHEMBL570318
Molecular FormulaC22H28O6
Molecular Weight388.46
Molecular Weight (Monoisotopic)388.1886
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsOcophylol C
SmilesC=CCC1=C[C@@]2(OC)[C@H](C)[C@@H](c3cc(OC)c(OC)c(OC)c3)[C@H](C1=O)[C@H]2O
InchiInChI=1S/C22H28O6/c1-7-8-13-11-22(28-6)12(2)17(18(19(13)23)21(22)24)14-9-15(25-3)20(27-5)16(10-14)26-4/h7,9-12,17-18,21,24H,1,8H2,2-6H3/t12-,17+,18-,21-,22-/m1/s1
Inchi KeyOXBOQKXJZRJDAW-UXPMNEGVSA-N
Molecular SpeciesNEUTRAL
Targets4.0
Bioactivities7.0
Np Likeness Score1.98
Records Key['7']
Records Name['Ocophylol C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure