Bioactive Compound Details

BioIDbio318
NameANTIQUOL C
ChEMBL IDCHEMBL517452
Molecular FormulaC30H48O
Molecular Weight424.71
Molecular Weight (Monoisotopic)424.3705
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonymsantiquol C
SmilesCC(C)=CCC[C@@H](C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@@]12C
InchiInChI=1S/C30H48O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,12,15,21-22,25-26,31H,9,11,13-14,16-19H2,1-8H3/t21-,22+,25+,26+,28-,29+,30-/m1/s1
Inchi KeyZBFPGLKEWSMWSG-WZLOIPHISA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities5.0
Np Likeness Score3.49
Records Key['2, antiquol C']
Records Name['eupha-7,9(11),24-trien-3beta-o']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure