Bioactive Compound Details

BioIDbio1262
NameBERKAZAPHILONE C
ChEMBL IDCHEMBL2024575
Molecular FormulaC21H22O7
Molecular Weight386.4
Molecular Weight (Monoisotopic)386.1366
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsBerkazaphilone C
SmilesC/C=C/C1=CC2=CC(=O)[C@](C)(O)[C@H](OC(=O)c3c(C)cc(O)cc3O)[C@H]2CO1
InchiInChI=1S/C21H22O7/c1-4-5-14-7-12-8-17(24)21(3,26)19(15(12)10-27-14)28-20(25)18-11(2)6-13(22)9-16(18)23/h4-9,15,19,22-23,26H,10H2,1-3H3/b5-4+/t15-,19+,21-/m0/s1
Inchi KeyHNVJWWBKFFDQAA-NRKPLWJESA-N
Molecular SpeciesNEUTRAL
Targets4.0
Bioactivities5.0
Np Likeness Score2.54
Records Key['4']
Records Name['berkazaphilone C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure