Bioactive Compound Details

BioIDbio1343
NameMACHAERIDIOL C
ChEMBL IDCHEMBL466161
Molecular FormulaC24H26O3
Molecular Weight362.47
Molecular Weight (Monoisotopic)362.1882
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsMachaeridiol C
SmilesC=C(C)[C@H]1CC[C@H](C)C[C@@H]1c1c(O)cc(-c2cc3ccccc3o2)cc1O
InchiInChI=1S/C24H26O3/c1-14(2)18-9-8-15(3)10-19(18)24-20(25)11-17(12-21(24)26)23-13-16-6-4-5-7-22(16)27-23/h4-7,11-13,15,18-19,25-26H,1,8-10H2,2-3H3/t15-,18+,19-/m0/s1
Inchi KeyUPLNMKNMLLBKKI-IPELMVKDSA-N
Molecular SpeciesNEUTRAL
Targets9.0
Bioactivities23.0
Np Likeness Score1.33
Records Key['5, Machaeridiol C']
Records Name['2-[1S,2S-(1-methylethenyl)-5S-methylcyclohexyl]-5-benzo[b]furan-1-yl-1,3-benzenediol']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure