Bioactive Compound Details

BioIDbio1090
NameMYRICANANIN C
ChEMBL IDCHEMBL522962
Molecular FormulaC20H22O4
Molecular Weight326.39
Molecular Weight (Monoisotopic)326.1518
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsMyricananin C
SmilesCOc1cc2cc(c1O)-c1cc(ccc1O)CCC(=O)CCCC2
InchiInChI=1S/C20H22O4/c1-24-19-12-14-4-2-3-5-15(21)8-6-13-7-9-18(22)16(10-13)17(11-14)20(19)23/h7,9-12,22-23H,2-6,8H2,1H3
Inchi KeyKNELQMDBXBOTFN-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities8.0
Np Likeness Score1.86
Records Key['3, Myricananin C', '160']
Records Name['3,17-dihydroxy-16-methoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaen-9-one', 'Myricananin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure