CHEBI:198426 - Cucumin C

ChEBI IDCHEBI:198426
ChEBI NameCucumin C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O3
Net Charge0
Average Mass244.290
Monoisotopic Mass244.10994
SMILESC[C@H]1C(=O)C=C2C=C3C(=O)C(C)(C)[C@@H]4O[C@]34[C@@]21C
InChIInChI=1S/C15H16O3/c1-7-10(16)6-8-5-9-11(17)13(2,3)12-15(9,18-12)14(7,8)4/h5-7,12H,1-4H3/t7-,12-,14+,15+/m0/s1
InChIKeyZPLMTMIKIAMSBW-QVEKHBHLSA-N
Species of MetaboliteComponentSourceComments
Macrocystidia cucumis (ncbitaxon:182055) - DOI (10.1002/(sici)1099-0690(199801)1998:1<73::aid-ejoc73>3.3.co;2-6)
ChEBI Ontology
Outgoing Relation(s)
Cucumin C (CHEBI:198426) is a oxanes (CHEBI:46942)
IUPAC Name 
(1R,2R,3R,11S)-2,3,10,10-tetramethyl-12-oxatetracyclo[6.4.0.01,11.02,6]dodeca-5,7-diene-4,9-dione
Manual XrefsDatabases
8056993ChemSpider