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CHEBI:229126 - Gardnerilin A

ChEBI IDCHEBI:229126
ChEBI NameGardnerilin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H66O8
Net Charge0
Average Mass614.905
Monoisotopic Mass614.47577
SMILESCCCCCCCCCCCCC(O)C(O)CCC(O)C(O)CCCCCCC(O)CCC[C@@H](O)CC1=C[C@H](C)OC1=O
InChIInChI=1S/C35H66O8/c1-3-4-5-6-7-8-9-10-11-15-21-31(38)33(40)23-24-34(41)32(39)22-16-13-12-14-18-29(36)19-17-20-30(37)26-28-25-27(2)43-35(28)42/h25,27,29-34,36-41H,3-24,26H2,1-2H3/t27-,29?,30+,31?,32?,33?,34?/m0/s1
InChIKeyWXGBJURRRZPBDS-MOZMCZEASA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
Gardnerilin A (CHEBI:229126) is a polyketide (CHEBI:26188)
IUPAC Name 
(2S)-4-[(2R)-2,6,13,14,17,18-hexahydroxytriacontyl]-2-methyl-2H-uran-5-one
Manual XrefsDatabases
8683436ChemSpider