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CHEBI:188056 - Palmyrolide A

ChEBI IDCHEBI:188056
ChEBI NamePalmyrolide A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H35NO3
Net Charge0
Average Mass337.504
Monoisotopic Mass337.26169
SMILES[H][C@@]1(C(C)(C)C)C[C@@H](C)CCCC(=O)N(C)/C=C/CC[C@H](C)C(=O)O1
InChIInChI=1S/C20H35NO3/c1-15-10-9-12-18(22)21(6)13-8-7-11-16(2)19(23)24-17(14-15)20(3,4)5/h8,13,15-17H,7,9-12,14H2,1-6H3/b13-8+/t15-,16-,17-/m0/s1
InChIKeyWRIPSIKIDAUKBP-ACXXYUNLSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2224)
ChEBI Ontology
Outgoing Relation(s)
Palmyrolide A (CHEBI:188056) is a azamacrocycle (CHEBI:52898)
Palmyrolide A (CHEBI:188056) is a keratan 6'-sulfate (CHEBI:18331)
IUPAC Name 
(3S,6E,13S,15S)-15-tert-butyl-3,8,13-trimethyl-1-oxa-8-azacyclopentadec-6-ene-2,9-dione
Manual XrefsDatabases
28637870ChemSpider