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CHEBI:198592 - Madangolide

ChEBI IDCHEBI:198592
ChEBI NameMadangolide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H39NO3
Net Charge0
Average Mass377.569
Monoisotopic Mass377.29299
SMILESCC1CCC(C)C(=O)N(C)/C=C\C=C/CCC(C)C(=O)OC(C(C)(C)C)C1
InChIInChI=1S/C23H39NO3/c1-17-13-14-18(2)21(25)24(7)15-11-9-8-10-12-19(3)22(26)27-20(16-17)23(4,5)6/h8-9,11,15,17-20H,10,12-14,16H2,1-7H3/b9-8-,15-11-
InChIKeyPZISRZRLNYYESW-SCLISBBUSA-N
Species of MetaboliteComponentSourceComments
Moorena bouillonii (ncbitaxon:207920) - PubMed (10395526)
ChEBI Ontology
Outgoing Relation(s)
Madangolide (CHEBI:198592) is a azamacrocycle (CHEBI:52898)
Madangolide (CHEBI:198592) is a keratan 6'-sulfate (CHEBI:18331)
IUPAC Name 
(10Z,12Z)-2-tert-butyl-4,7,9,16-tetramethyl-1-oxa-9-azacycloheptadeca-10,12-diene-8,17-dione
Manual XrefsDatabases
10205974ChemSpider