Bioactive Compound Details

BioIDbio1194
NameFORRESTIN C
ChEMBL IDCHEMBL512631
Molecular FormulaC26H38O9
Molecular Weight494.58
Molecular Weight (Monoisotopic)494.2516
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsForrestin C
SmilesC=C1[C@@H]2C[C@H](OC(C)=O)[C@H]3[C@]4(C)[C@@H](OC(C)=O)C[C@H](O)C(C)(C)[C@H]4[C@H](O)[C@H](OC(C)=O)[C@]3(C2)[C@@H]1O
InchiInChI=1S/C26H38O9/c1-11-15-8-16(33-12(2)27)20-25(7)18(34-13(3)28)9-17(30)24(5,6)21(25)19(31)23(35-14(4)29)26(20,10-15)22(11)32/h15-23,30-32H,1,8-10H2,2-7H3/t15-,16+,17+,18+,19+,20+,21-,22-,23+,25+,26+/m1/s1
Inchi KeyWNWJAUVVIRZDLV-LOJDAGIGSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities3.0
Np Likeness Score3.27
Records Key['18']
Records Name['forrestin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure