Bioactive Compound Details

BioIDbio585
NameNone
ChEMBL IDCHEMBL1940603
Molecular FormulaC41H40O8
Molecular Weight660.76
Molecular Weight (Monoisotopic)660.2723
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonyms(+/-)-Chartaceone C
SmilesO=C(O)CCC/C=C/C(c1ccccc1)c1c(O)c2c(c(C(/C=C/CCCC(=O)O)c3ccccc3)c1O)OC(c1ccccc1)CC2=O
InchiInChI=1S/C41H40O8/c42-32-26-33(29-20-10-3-11-21-29)49-41-37(31(28-18-8-2-9-19-28)23-13-5-15-25-35(45)46)39(47)36(40(48)38(32)41)30(27-16-6-1-7-17-27)22-12-4-14-24-34(43)44/h1-3,6-13,16-23,30-31,33,47-48H,4-5,14-15,24-26H2,(H,43,44)(H,45,46)/b22-12+,23-13+
Inchi KeyRGZSPQYXJSDKAN-FWSOMWAYSA-N
Molecular SpeciesACID
Targets2.0
Bioactivities3.0
Np Likeness Score1.15
Records Key['3']
Records Name['(+/-)-Chartaceone C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure