Bioactive Compound Details

BioIDbio428
NameHOIAMIDE C
ChEMBL IDCHEMBL1215860
Molecular FormulaC37H62N4O7S3
Molecular Weight771.12
Molecular Weight (Monoisotopic)770.3781
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsHoiamide C
SmilesCCC[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@@H](C)[C@H](Cc1nc(C2=N[C@@](C)(C3=N[C@@](C)(C(=O)N[C@H]([C@@H](O)[C@@H](C)C(=O)OCC)[C@@H](C)CC)CS3)CS2)cs1)OC
InchiInChI=1S/C37H62N4O7S3/c1-12-15-21(5)29(42)23(7)30(43)22(6)26(47-11)16-27-38-25(17-49-27)32-40-37(10,19-50-32)35-41-36(9,18-51-35)34(46)39-28(20(4)13-2)31(44)24(8)33(45)48-14-3/h17,20-24,26,28-31,42-44H,12-16,18-19H2,1-11H3,(H,39,46)/t20-,21+,22-,23-,24+,26-,28-,29-,30-,31-,36+,37+/m0/s1
Inchi KeySTGNMXQTWDOGSE-FUVSMVGWSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities4.0
Np Likeness Score0.35
Records Key['3']
Records Name['Hoiamide C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure