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CHEBI:229063 - Aucubigenin

ChEBI IDCHEBI:229063
ChEBI NameAucubigenin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H12O4
Net Charge0
Average Mass184.191
Monoisotopic Mass184.07356
SMILES[H][C@@]12C=CO[C@@H](O)[C@]1([H])C(CO)=C[C@H]2O
InChIInChI=1S/C9H12O4/c10-4-5-3-7(11)6-1-2-13-9(12)8(5)6/h1-3,6-12H,4H2/t6-,7+,8+,9+/m0/s1
InChIKeyBACWCXKATFIVFS-JQCXWYLXSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
Aucubigenin (CHEBI:229063) is a iridoid monoterpenoid (CHEBI:50563)
IUPAC Name 
(1R,4aR,5S,7aS)-7-(hydroxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1,5-diol
Manual XrefsDatabases
143116ChemSpider