Bioactive Compound Details

BioIDbio55
NameRABDOTERNIN C
ChEMBL IDCHEMBL253550
Molecular FormulaC24H34O7
Molecular Weight434.53
Molecular Weight (Monoisotopic)434.2305
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsRabdoternin C
SmilesC=C1[C@@H](OC(C)=O)[C@]23[C@H](O)[C@H]1CC[C@H]2[C@]12CCCC(C)(C)[C@H]1[C@H](OC(C)=O)[C@]3(O)OC2
InchiInChI=1S/C24H34O7/c1-12-15-7-8-16-22-10-6-9-21(4,5)17(22)20(31-14(3)26)24(28,29-11-22)23(16,18(15)27)19(12)30-13(2)25/h15-20,27-28H,1,6-11H2,2-5H3/t15-,16-,17+,18+,19+,20-,22+,23+,24-/m0/s1
Inchi KeyZPDVFDNDMSYUSR-WLMSFTOLSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities3.0
Np Likeness Score3.49
Records Key['21']
Records Name['rabdoternin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure