Bioactive Compound Details

BioIDbio853
NameTHYRSIFLORIN C
ChEMBL IDCHEMBL494208
Molecular FormulaC20H34O2
Molecular Weight306.49
Molecular Weight (Monoisotopic)306.2559
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsThyrsiflorin C
SmilesCC1(C)CCC[C@@]2(C)[C@H]1C[C@H](O)[C@H]1C[C@@H](O)[C@]3(C)CC[C@]12C3
InchiInChI=1S/C20H34O2/c1-17(2)6-5-7-19(4)15(17)11-14(21)13-10-16(22)18(3)8-9-20(13,19)12-18/h13-16,21-22H,5-12H2,1-4H3/t13-,14+,15+,16-,18-,19+,20+/m1/s1
Inchi KeyYQMNVINYONRZOE-SAHLWMROSA-N
Molecular SpeciesNEUTRAL
Targets6.0
Bioactivities7.0
Np Likeness Score3.47
Records Key['6, TC']
Records Name['thyrsiflorin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure