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CHEBI:198601 - Cucumin D

ChEBI IDCHEBI:198601
ChEBI NameCucumin D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H18O3
Net Charge0
Average Mass246.306
Monoisotopic Mass246.12559
SMILESC[C@H]1C(=O)C=C2CC3=C([C@@H](O)C(C)(C)C3=O)[C@@]21C
InChIInChI=1S/C15H18O3/c1-7-10(16)6-8-5-9-11(15(7,8)4)13(18)14(2,3)12(9)17/h6-7,13,18H,5H2,1-4H3/t7-,13+,15+/m0/s1
InChIKeyZJQBSHFABOKMJU-SBPMXOOQSA-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 D (CHEBI:198601) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(3R,3aR,4R)-4-hydroxy-3,3a,5,5-tetramethyl-4,7-dihydro-3H-cyclopenta[a]pentalene-2,6-dione
Manual XrefsDatabases
8666046ChemSpider