Bioactive Compound Details

BioIDbio1576
NameSAMADERINS C
ChEMBL IDCHEMBL2270646
Molecular FormulaC19H24O7
Molecular Weight364.39
Molecular Weight (Monoisotopic)364.1522
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsNone
SmilesCC1=C[C@H](O)[C@@H](O)[C@@]2(C)[C@H]1CC(=O)[C@@]13CO[C@]4(C)[C@@H](OC(=O)[C@@H]41)[C@H](O)[C@@H]32
InchiInChI=1S/C19H24O7/c1-7-4-9(20)14(23)17(2)8(7)5-10(21)19-6-25-18(3)13(19)16(24)26-15(18)11(22)12(17)19/h4,8-9,11-15,20,22-23H,5-6H2,1-3H3/t8-,9-,11+,12+,13-,14+,15-,17-,18-,19+/m0/s1
Inchi KeyPDGZDUYWUXJXRO-ANPVQLFHSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities10.0
Np Likeness Score3.81
Records Key['2']
Records Name['Samaderins C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure