Bioactive Compound Details

BioIDbio1323
NameALMIRAMIDE C
ChEMBL IDCHEMBL1095956
Molecular FormulaC40H66N6O6
Molecular Weight727.0
Molecular Weight (Monoisotopic)726.5044
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsAlmiramide C
SmilesC=CCCCC[C@@H](C)C(=O)N(C)[C@H](C(=O)N(C)[C@H](C(=O)N[C@H](C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O)C(C)C)C(C)C)C(C)C
InchiInChI=1S/C40H66N6O6/c1-14-15-16-18-21-28(8)37(49)46(13)34(27(6)7)40(52)45(12)33(26(4)5)36(48)42-32(25(2)3)39(51)43(10)29(9)38(50)44(11)31(35(41)47)24-30-22-19-17-20-23-30/h14,17,19-20,22-23,25-29,31-34H,1,15-16,18,21,24H2,2-13H3,(H2,41,47)(H,42,48)/t28-,29+,31+,32+,33+,34+/m1/s1
Inchi KeyQYTBDYVUMOVEHG-CWXFOQKSSA-N
Molecular SpeciesNEUTRAL
Targets6.0
Bioactivities9.0
Np Likeness Score0.68
Records Key['3', '9']
Records Name['Almiramide C', 'Almiramide C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure