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CHEBI:219036 - Sequoiatone C

ChEBI IDCHEBI:219036
ChEBI NameSequoiatone C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H30O5
Net Charge0
Average Mass374.477
Monoisotopic Mass374.20932
SMILESCCCCCC[C@H](C)C(=O)/C=C1\C(C(=O)OC)=C2C=COC(C)=C2[C@]1(C)O
InChIInChI=1S/C22H30O5/c1-6-7-8-9-10-14(2)18(23)13-17-19(21(24)26-5)16-11-12-27-15(3)20(16)22(17,4)25/h11-14,25H,6-10H2,1-5H3/b17-13+/t14-,22+/m0/s1
InChIKeyDYUPDLYFDGWNBP-TVXHFNGESA-N
Species of MetaboliteComponentSourceComments
Aspergillus parasiticus (ncbitaxon:5067) - PubMed (11678666)
ChEBI Ontology
Outgoing Relation(s)
Sequoiatone C (CHEBI:219036) is a pyrans (CHEBI:26407)
IUPAC Name 
methyl (6E,7R)-7-hydroxy-1,7-dimethyl-6-[(3S)-3-methyl-2-oxononylidene]cyclopenta[c]pyran-5-carboxylate
Manual XrefsDatabases
9090992ChemSpider