Bioactive Compound Details

BioIDbio602
NameJEZONOCINOL C
ChEMBL IDCHEMBL403353
Molecular FormulaC28H24O9
Molecular Weight504.49
Molecular Weight (Monoisotopic)504.142
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsJezonocinol C
SmilesO=C1C=C2O[C@H](c3ccc(O)c(O)c3)[C@@H](O)[C@@H]3c4c(O)cc(O)cc4[C@H](C23)[C@H](c2ccc(O)c(O)c2)C1
InchiInChI=1S/C28H24O9/c29-13-8-16-23-15(11-1-3-17(31)19(33)5-11)7-14(30)10-22-25(23)26(24(16)21(35)9-13)27(36)28(37-22)12-2-4-18(32)20(34)6-12/h1-6,8-10,15,23,25-29,31-36H,7H2/t15-,23+,25?,26+,27-,28+/m0/s1
Inchi KeyLCRLZIMLAUAPJF-IWSVXSTESA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities3.0
Np Likeness Score1.87
Records Key['3', '14']
Records Name['jezonocinol C', 'jezonocinol C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure