Bioactive Compound Details

BioIDbio967
NamePSEUDOPTEROSIN C
ChEMBL IDCHEMBL478977
Molecular FormulaC27H38O7
Molecular Weight474.59
Molecular Weight (Monoisotopic)474.2618
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsPseudopterosin C
SmilesCC(=O)O[C@@H]1[C@@H](O)[C@H](Oc2c(O)c(C)c3c4c2[C@@H](C)CC[C@@H]4[C@@H](C)C[C@@H]3C=C(C)C)OC[C@H]1O
InchiInChI=1S/C27H38O7/c1-12(2)9-17-10-14(4)18-8-7-13(3)20-22(18)21(17)15(5)23(30)26(20)34-27-24(31)25(33-16(6)28)19(29)11-32-27/h9,13-14,17-19,24-25,27,29-31H,7-8,10-11H2,1-6H3/t13-,14-,17-,18+,19+,24+,25-,27-/m0/s1
Inchi KeyKFGFLTUAFJTHSD-HPZAAEPWSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities3.0
Np Likeness Score2.52
Records Key['9']
Records Name['pseudopterosin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure