Bioactive Compound Details

BioIDbio818
NameNone
ChEMBL IDCHEMBL1093736
Molecular FormulaC16H24O7
Molecular Weight328.36
Molecular Weight (Monoisotopic)328.1522
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonyms(-)-Isocitruscin C
SmilesCCCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(OC)c1
InchiInChI=1S/C16H24O7/c1-3-4-9-5-6-10(11(7-9)21-2)22-16-15(20)14(19)13(18)12(8-17)23-16/h5-7,12-20H,3-4,8H2,1-2H3/t12-,13-,14+,15-,16-/m1/s1
Inchi KeyOEKQEDBCPPNGKO-IBEHDNSVSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities9.0
Np Likeness Score1.54
Records Key['22']
Records Name['(-)-isocitruscin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure