Bioactive Compound Details

BioIDbio1527
NameRHABDASTRELLIN C
ChEMBL IDCHEMBL488978
Molecular FormulaC30H46O5
Molecular Weight486.69
Molecular Weight (Monoisotopic)486.3345
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsRhabdastrellin C
SmilesCC(/C=C/C(O)C(C)(C)O)=C\C=C\C(C)=C1\C(=O)C[C@H]2[C@@]3(C)CC[C@H](O)[C@](C)(CO)[C@@H]3CC[C@]12C
InchiInChI=1S/C30H46O5/c1-19(11-12-24(33)27(3,4)35)9-8-10-20(2)26-21(32)17-23-28(5)16-14-25(34)30(7,18-31)22(28)13-15-29(23,26)6/h8-12,22-25,31,33-35H,13-18H2,1-7H3/b10-8+,12-11+,19-9+,26-20-/t22-,23+,24?,25+,28+,29+,30-/m1/s1
Inchi KeyWKAINZFICWJPQH-LRACOFGXSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score3.13
Records Key['3']
Records Name['rhabdastrellin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure