Bioactive Compound Details

BioIDbio71
NamePOLYPORUSTERONE C
ChEMBL IDCHEMBL410507
Molecular FormulaC28H44O6
Molecular Weight476.65
Molecular Weight (Monoisotopic)476.3138
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsPolyporusterone C
SmilesCC(C)C(C)C1O[C@H]1[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C
InchiInChI=1S/C28H44O6/c1-14(2)15(3)23-24(34-23)27(6,32)22-8-10-28(33)17-11-19(29)18-12-20(30)21(31)13-25(18,4)16(17)7-9-26(22,28)5/h11,14-16,18,20-24,30-33H,7-10,12-13H2,1-6H3/t15?,16-,18-,20+,21-,22-,23?,24+,25+,26+,27+,28+/m0/s1
Inchi KeyXOSHHFGXQBEREG-ZTBSBOJQSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities2.0
Np Likeness Score3.93
Records Key['64', '5']
Records Name['Polyporusterone C', 'Polyporusterone C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure