Bioactive Compound Details

BioIDbio1717
NameTENUIFOLIN C
ChEMBL IDCHEMBL2334476
Molecular FormulaC26H36O8
Molecular Weight476.57
Molecular Weight (Monoisotopic)476.241
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonymstenuifolin C
SmilesC=C1[C@@H]2C[C@H](OC(C)=O)[C@@H]3[C@](C2)(C(=O)C[C@@H]2C(C)(C)[C@@H](O)C[C@H](OC(C)=O)[C@]23C)[C@@H]1OC(C)=O
InchiInChI=1S/C26H36O8/c1-12-16-8-17(32-13(2)27)22-25(7)18(24(5,6)19(30)10-21(25)33-14(3)28)9-20(31)26(22,11-16)23(12)34-15(4)29/h16-19,21-23,30H,1,8-11H2,2-7H3/t16-,17+,18-,19+,21+,22+,23-,25+,26+/m1/s1
Inchi KeyVTAYJHOHGSJXDY-BSLCUUFRSA-N
Molecular SpeciesNEUTRAL
Targets6.0
Bioactivities7.0
Np Likeness Score3.24
Records Key['6, tenuifolin C']
Records Name['3beta-hydroxy-1alpha,11beta,15beta-triacetoxyent-kaur-16-en-7-one']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure