Bioactive Compound Details

BioIDbio196
NameCHAXAMYCIN C
ChEMBL IDCHEMBL1814386
Molecular FormulaC35H45NO11
Molecular Weight655.74
Molecular Weight (Monoisotopic)655.2993
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsChaxamycin C
SmilesCC1=C2NC(=O)/C=C\C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@@H](CO)/C=C(\C)C(=O)c3c(O)c(C)c(O)c(c3C1=O)C2=O
InchiInChI=1S/C35H45NO11/c1-14-10-8-9-11-22(38)36-26-16(3)32(44)23-24(33(45)20(7)34(46)25(23)35(26)47)28(40)15(2)12-21(13-37)31(43)19(6)30(42)18(5)29(41)17(4)27(14)39/h8-12,14,17-19,21,27,29-31,37,39,41-43,45-46H,13H2,1-7H3,(H,36,38)/b10-8+,11-9-,15-12+/t14-,17+,18+,19-,21+,27-,29+,30-,31+/m0/s1
Inchi KeyDKNKXGMUDKSFMM-RRFXWELOSA-N
Molecular SpeciesACID
Targets1.0
Bioactivities1.0
Np Likeness Score1.88
Records Key['3']
Records Name['Chaxamycin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure