Bioactive Compound Details

BioIDbio1394
NameREZISHANONE C
ChEMBL IDCHEMBL465811
Molecular FormulaC18H24O5
Molecular Weight320.39
Molecular Weight (Monoisotopic)320.1624
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsRezishanone C
SmilesC/C=C/C=C/C(O)=C1\C(=O)[C@]2(C)C(=O)[C@@](C)(O)[C@H]1C[C@@H]2OCC
InchiInChI=1S/C18H24O5/c1-5-7-8-9-12(19)14-11-10-13(23-6-2)17(3,15(14)20)16(21)18(11,4)22/h5,7-9,11,13,19,22H,6,10H2,1-4H3/b7-5+,9-8+,14-12+/t11-,13-,17+,18-/m0/s1
Inchi KeyOYVREVFYRWCTER-GXMVIZQESA-N
Molecular SpeciesNEUTRAL
Targets9.0
Bioactivities9.0
Np Likeness Score2.41
Records Key['13b']
Records Name['Rezishanone C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure