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CHEBI:172524 - Cyclocalopin F

ChEBI IDCHEBI:172524
ChEBI NameCyclocalopin F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H18O6
Net Charge0
Average Mass294.303
Monoisotopic Mass294.11034
SMILES[H][C@]12[C@H](C)COC(=O)[C@@]1([H])O[C@@]1(C)O[C@@]3([H])C[C@]12[C@@H](O)C(=O)C3=C
InChIInChI=1S/C15H18O6/c1-6-5-19-13(18)11-9(6)15-4-8(20-14(15,3)21-11)7(2)10(16)12(15)17/h6,8-9,11-12,17H,2,4-5H2,1,3H3/t6-,8+,9+,11+,12+,14-,15+/m1/s1
InChIKeyUGWYLYUJRHPKJY-BLRPRONUSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
Cyclocalopin F (CHEBI:172524) is a furopyran (CHEBI:74927)
IUPAC Name 
(1S,2R,3S,7S,9R,11S,14R)-14-hydroxy-3,9-dimethyl-12-methylidene-5,8,10-trioxatetracyclo[9.3.1.01,9.02,7]pentadecane-6,13-dione
Manual XrefsDatabases
9045390ChemSpider