Bioactive Compound Details

BioIDbio981
NameMYCALAMIDE C
ChEMBL IDCHEMBL509856
Molecular FormulaC20H35NO8
Molecular Weight417.5
Molecular Weight (Monoisotopic)417.2363
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsMycalamide C
SmilesC=C1C[C@](OC)([C@H](O)C(=O)NC[C@H]2O[C@H](CO)C(C)(C)[C@H](O)[C@H]2O)O[C@H](C)[C@@H]1C
InchiInChI=1S/C20H35NO8/c1-10-7-20(27-6,29-12(3)11(10)2)17(25)18(26)21-8-13-15(23)16(24)19(4,5)14(9-22)28-13/h11-17,22-25H,1,7-9H2,2-6H3,(H,21,26)/t11-,12-,13-,14-,15+,16-,17-,20-/m1/s1
Inchi KeyDCZMMILMODFEMS-AUYDAGNDSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score2.5
Records Key['3']
Records Name['mycalamide C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure