Bioactive Compound Details

BioIDbio1556
NameEUPHORBIAPROLIFERIN C
ChEMBL IDCHEMBL1927832
Molecular FormulaC32H44O12
Molecular Weight620.69
Molecular Weight (Monoisotopic)620.2833
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsEuphorbiaproliferin C
SmilesCC(=O)O[C@@H]1[C@H]2[C@@H](OC(=O)C(C)C)[C@@H](C)C[C@]2(OC(C)=O)[C@@H](OC(C)=O)[C@]2(C)OC[C@]13C(=O)C=C[C@H](C(C)(C)OC(C)=O)[C@@H]23
InchiInChI=1S/C32H44O12/c1-15(2)27(38)42-24-16(3)13-32(44-20(7)36)23(24)26(40-17(4)33)31-14-39-30(10,28(32)41-18(5)34)25(31)21(11-12-22(31)37)29(8,9)43-19(6)35/h11-12,15-16,21,23-26,28H,13-14H2,1-10H3/t16-,21-,23+,24-,25-,26+,28-,30+,31+,32+/m0/s1
Inchi KeyMEMULCZBXUZFOZ-XBPHKDPRSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities9.0
Np Likeness Score2.8
Records Key['3, Euphorbiaproliferin C', '3']
Records Name['3beta-O-isobutyryl-5alpha,10,14beta,15beta-tetra-O-acetyl-7-oxo-10,18-dihydromyrsinol', 'falcatin C; 5alpha,10,14beta,15beta-O-tetraacetyl-3beta-O-isobutyryl-10,18-dihydromyrsinol']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure