Bioactive Compound Details

BioIDbio1693
NameSALVADIONE C
ChEMBL IDCHEMBL1928366
Molecular FormulaC30H40O5
Molecular Weight480.65
Molecular Weight (Monoisotopic)480.2876
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsSalvadione C
SmilesC=CC1=C[C@@H]2[C@@H]3[C@]4(C(C)C)C(=O)[C@]5(CC[C@H]6C(C)(C)CCC[C@]67C[C@]25[C@@](OC[C@@]3(C)O)(O7)C4=O)C1
InchiInChI=1S/C30H40O5/c1-7-18-13-19-21-25(6,33)16-34-30-23(32)29(21,17(2)3)22(31)26(14-18)12-9-20-24(4,5)10-8-11-27(20,35-30)15-28(19,26)30/h7,13,17,19-21,33H,1,8-12,14-16H2,2-6H3/t19-,20+,21+,25-,26+,27+,28+,29-,30+/m1/s1
Inchi KeyFOQBZJXMAZZAIA-NQWLPLNFSA-N
Molecular SpeciesNEUTRAL
Targets4.0
Bioactivities5.0
Np Likeness Score2.95
Records Key['1']
Records Name['salvadione C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure