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CHEBI:31908 - Niddamycin

Default Structure
ChEBI IDCHEBI:31908
ChEBI NameNiddamycin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC39H63NO14
Net Charge0
Average Mass769.926
Monoisotopic Mass769.42486
SMILESCO[C@@H]1[C@@H](O[C@@H]2O[C@H](C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](OC(=O)C(C)C)[C@H](C)O3)[C@H](N(C)C)[C@H]2O)[C@@H](CC=O)C[C@@H](C)C(=O)/C=C/C=C/C[C@@H](C)OC(=O)C[C@H]1O
InChIInChI=1S/C39H63NO14/c1-21(2)37(46)54-36-25(6)50-30(20-39(36,7)47)52-33-24(5)51-38(32(45)31(33)40(8)9)53-34-26(16-17-41)18-22(3)27(42)15-13-11-12-14-23(4)49-29(44)19-28(43)35(34)48-10/h11-13,15,17,21-26,28,30-36,38,43,45,47H,14,16,18-20H2,1-10H3/b12-11+,15-13+/t22-,23-,24-,25+,26+,28-,30+,31-,32-,33-,34+,35+,36+,38+,39-/m1/s1
InChIKeyREPPNUPKOJKPSP-ZZNWINOMSA-N
ChEBI Ontology
Outgoing Relation(s)
Niddamycin (CHEBI:31908) is a macrolide (CHEBI:25106)
Synonym  Source
NiddamycinKEGG COMPOUND
Manual XrefsDatabases
C12152KEGG COMPOUND
Registry NumbersSources
CAS:20283-69-6KEGG COMPOUND