Bioactive Compound Details

BioIDbio1450
NameEHRENBEROXIDE C
ChEMBL IDCHEMBL1084907
Molecular FormulaC19H32O3
Molecular Weight308.46
Molecular Weight (Monoisotopic)308.2351
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsEhrenberoxide C
SmilesC/C1=C\C=C(\C(C)C)C[C@](C)(O)[C@H]2CC[C@](C)(O)[C@@H](CC1)O2
InchiInChI=1S/C19H32O3/c1-13(2)15-8-6-14(3)7-9-16-18(4,20)11-10-17(22-16)19(5,21)12-15/h6,8,13,16-17,20-21H,7,9-12H2,1-5H3/b14-6+,15-8+/t16-,17-,18+,19+/m1/s1
Inchi KeyADRQUYQPINKXPW-RWOJJBTQSA-N
Molecular SpeciesNEUTRAL
Targets5.0
Bioactivities5.0
Np Likeness Score2.62
Records Key['6']
Records Name['ehrenberoxide C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure