Bioactive Compound Details

BioIDbio495
NamePOUOGENIN C
ChEMBL IDCHEMBL1927960
Molecular FormulaC34H54O7
Molecular Weight574.8
Molecular Weight (Monoisotopic)574.387
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsPouogenin C
SmilesCC(=O)O[C@@H](C[C@@H]1C(C)=CCC(=O)C1(C)C)/C(C)=C/[C@H](O)C/C=C(\C)CC[C@H]1C(C)(C)[C@@H](O)CC[C@]1(C)OC(C)=O
InchiInChI=1S/C34H54O7/c1-21(12-15-29-33(8,9)31(39)17-18-34(29,10)41-25(5)36)11-14-26(37)19-23(3)28(40-24(4)35)20-27-22(2)13-16-30(38)32(27,6)7/h11,13,19,26-29,31,37,39H,12,14-18,20H2,1-10H3/b21-11+,23-19+/t26-,27-,28+,29+,31+,34+/m1/s1
Inchi KeyPTJLIXKRHKJPSE-FJZBMYBNSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score2.97
Records Key['7']
Records Name['Pouogenin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure