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CHEBI:202742 - Sequoiatone F

ChEBI IDCHEBI:202742
ChEBI NameSequoiatone F
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H32O5
Net Charge0
Average Mass376.493
Monoisotopic Mass376.22497
SMILESCCCCCC[C@H](C)C(=O)/C=C1\C(C(=O)OC)=C2C=C(C)OCC2[C@]1(C)O
InChIInChI=1S/C22H32O5/c1-6-7-8-9-10-14(2)19(23)12-17-20(21(24)26-5)16-11-15(3)27-13-18(16)22(17,4)25/h11-12,14,18,25H,6-10,13H2,1-5H3/b17-12+/t14-,18?,22+/m0/s1
InChIKeyZSIVCMRKIFUXRS-MUYSIRPJSA-N
Species of MetaboliteComponentSourceComments
Aspergillus parasiticus (ncbitaxon:5067) - PubMed (11678666)
ChEBI Ontology
Outgoing Relation(s)
Sequoiatone F (CHEBI:202742) is a iridoid monoterpenoid (CHEBI:50563)
IUPAC Name 
methyl (6E,7S)-7-hydroxy-3,7-dimethyl-6-[(3S)-3-methyl-2-oxononylidene]-1,7a-dihydrocyclopenta[c]pyran-5-carboxylate
Manual XrefsDatabases
9903238ChemSpider