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CHEBI:221478 - Triedimycin B

ChEBI IDCHEBI:221478
ChEBI NameTriedimycin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC37H53N3O9
Net Charge0
Average Mass683.843
Monoisotopic Mass683.37818
SMILESCOC(CC(C)C(O)/C=C/C=C/CNC(=O)C(C)(C)C(O)/C(C)=C/C=C/C=C/Cc1cnc(C)o1)C1(O)C(C)C(=O)N(C)C12C(=O)OC2C
InChIInChI=1S/C37H53N3O9/c1-23(17-13-10-11-14-18-28-22-39-27(5)49-28)31(42)35(6,7)33(44)38-20-16-12-15-19-29(41)24(2)21-30(47-9)37(46)25(3)32(43)40(8)36(37)26(4)48-34(36)45/h10-17,19,22,24-26,29-31,41-42,46H,18,20-21H2,1-9H3,(H,38,44)/b13-10+,14-11+,16-12+,19-15+,23-17+
InChIKeyAIFNQWJNODEFQR-FHEGIQTASA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (1903377)
ChEBI Ontology
Outgoing Relation(s)
Triedimycin B (CHEBI:221478) has functional parent α-amino acid (CHEBI:33704)
Triedimycin B (CHEBI:221478) is a organonitrogen compound (CHEBI:35352)
Triedimycin B (CHEBI:221478) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(4E,6E,8E)-3-hydroxy-N-[(2E,4E)-6-hydroxy-9-(8-hydroxy-1,5,7-trimethyl-3,6-dioxo-2-oxa-5-azaspiro[3.4]octan-8-yl)-9-methoxy-7-methylnona-2,4-dienyl]-2,2,4-trimethyl-10-(2-methyl-1,3-oxazol-5-yl)deca-4,6,8-trienamide
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