Bioactive Compound Details

BioIDbio572
NameKOPSILOSCINE C
ChEMBL IDCHEMBL253772
Molecular FormulaC23H28N2O7
Molecular Weight444.48
Molecular Weight (Monoisotopic)444.1897
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsKopsiloscine C
SmilesCOC(=O)N1c2ccccc2[C@@]23CCN4CC[C@H](O)[C@@]5(CC[C@]12[C@](O)(C(=O)OC)[C@H]5O)[C@H]43
InchiInChI=1S/C23H28N2O7/c1-31-18(28)23(30)17(27)20-8-9-22(23)21(10-12-24(16(20)21)11-7-15(20)26)13-5-3-4-6-14(13)25(22)19(29)32-2/h3-6,15-17,26-27,30H,7-12H2,1-2H3/t15-,16-,17-,20-,21+,22-,23+/m0/s1
Inchi KeyIICJDWBFZMYHKV-IFDKZNJJSA-N
Molecular SpeciesBASE
Targets2.0
Bioactivities3.0
Np Likeness Score2.33
Records Key['4']
Records Name['kopsiloscine C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure