Bioactive Compound Details

BioIDbio1311
NameBASILIOLIDE C
ChEMBL IDCHEMBL486792
Molecular FormulaC22H26O7
Molecular Weight402.44
Molecular Weight (Monoisotopic)402.1679
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsBasiliolide C
SmilesC=C[C@@]1(C)CC[C@H]2[C@](C)(COC(C)=O)[C@H]3C=C4C=C(OC)OC(=O)[C@@H]1[C@@]42OC3=O
InchiInChI=1S/C22H26O7/c1-6-20(3)8-7-15-21(4,11-27-12(2)23)14-9-13-10-16(26-5)28-19(25)17(20)22(13,15)29-18(14)24/h6,9-10,14-15,17H,1,7-8,11H2,2-5H3/t14-,15-,17-,20-,21+,22+/m0/s1
Inchi KeySLHAUOLJOBMVRP-OPZFZUIKSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score3.17
Records Key['2d']
Records Name['Basiliolide C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure