Bioactive Compound Details

BioIDbio1052
NameNone
ChEMBL IDCHEMBL469629
Molecular FormulaC21H28O4
Molecular Weight344.45
Molecular Weight (Monoisotopic)344.1988
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonyms15,16-Dihydroswartziarboreol C
SmilesCOc1c(O)c2c(c3c1CCOC3=O)CC[C@H]1C(C)(C)CCC[C@]21C
InchiInChI=1S/C21H28O4/c1-20(2)9-5-10-21(3)14(20)7-6-12-15-13(8-11-25-19(15)23)18(24-4)17(22)16(12)21/h14,22H,5-11H2,1-4H3/t14-,21-/m0/s1
Inchi KeyQAIIXQJPXUSTBS-QKKBWIMNSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities5.0
Np Likeness Score2.51
Records Key['2', '11']
Records Name['15,16-dihydroswartziarboreol C', '15,16-dihydroswartziarboreol C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure