Bioactive Compound Details

BioIDbio1360
NameEUPHOSCOPIN C
ChEMBL IDCHEMBL506068
Molecular FormulaC38H44O9
Molecular Weight644.76
Molecular Weight (Monoisotopic)644.2985
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsEuphoscopin C
SmilesCC(=O)O[C@@H]1[C@H](C)/C=C/C(C)(C)C(=O)C[C@@H](OC(=O)c2ccccc2)/C(C)=C/[C@H]2[C@@H](OC(=O)c3ccccc3)[C@H](C)C[C@]12OC(C)=O
InchiInChI=1S/C38H44O9/c1-23-18-19-37(6,7)32(41)21-31(45-35(42)28-14-10-8-11-15-28)24(2)20-30-33(46-36(43)29-16-12-9-13-17-29)25(3)22-38(30,47-27(5)40)34(23)44-26(4)39/h8-20,23,25,30-31,33-34H,21-22H2,1-7H3/b19-18+,24-20+/t23-,25-,30+,31-,33+,34-,38-/m1/s1
Inchi KeyZMQZEEAERZPRGX-CFAJCEJWSA-N
Molecular SpeciesNEUTRAL
Targets5.0
Bioactivities7.0
Np Likeness Score2.08
Records Key['4a', '3', '10', '4']
Records Name['euphoscopin C', 'Euphoscopin C', 'Euphoscopin C', 'Euphoscopin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure