Bioactive Compound Details

BioIDbio259
NameSARCOVAGINE C
ChEMBL IDCHEMBL504924
Molecular FormulaC29H48N2O3
Molecular Weight472.71
Molecular Weight (Monoisotopic)472.3665
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsSarcovagine C
SmilesC/C=C(\C)C(=O)N[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@@H]([C@H](C)NC)CC[C@H]4[C@@H]3CC[C@H]2[C@H]1OC(C)=O
InchiInChI=1S/C29H48N2O3/c1-8-17(2)27(33)31-25-14-16-29(6)23-13-15-28(5)21(18(3)30-7)11-12-22(28)20(23)9-10-24(29)26(25)34-19(4)32/h8,18,20-26,30H,9-16H2,1-7H3,(H,31,33)/b17-8+/t18-,20-,21+,22-,23-,24-,25-,26+,28+,29+/m0/s1
Inchi KeyJGVUURLOQKRQKQ-ZLTQYVKSSA-N
Molecular SpeciesBASE
Targets7.0
Bioactivities10.0
Np Likeness Score2.19
Records Key['10']
Records Name['sarcovagine C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure