Bioactive Compound Details

BioIDbio803
NameAGLAIABBREVIATIN C
ChEMBL IDCHEMBL1651316
Molecular FormulaC24H40O2
Molecular Weight360.58
Molecular Weight (Monoisotopic)360.3028
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsAglaiabbreviatin C
SmilesCC(=O)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CC[C@@H](O)C(C)(C)[C@@H]3CC[C@]12C
InchiInChI=1S/C24H40O2/c1-15(25)16-9-13-23(5)17(16)7-8-19-22(4)12-11-20(26)21(2,3)18(22)10-14-24(19,23)6/h16-20,26H,7-14H2,1-6H3/t16-,17-,18+,19-,20-,22+,23-,24-/m1/s1
Inchi KeyGRVOAMBHUWXGTO-NICZXZAASA-N
Molecular SpeciesNEUTRAL
Targets5.0
Bioactivities6.0
Np Likeness Score2.79
Records Key['3']
Records Name['Aglaiabbreviatin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure