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CHEBI:205797 - Quadricinctapyran B

ChEBI IDCHEBI:205797
ChEBI NameQuadricinctapyran B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H14O5
Net Charge0
Average Mass262.261
Monoisotopic Mass262.08412
SMILESCC(=O)OC[C@]1(C)C=Cc2cc(C(=O)O)ccc2O1
InChIInChI=1S/C14H14O5/c1-9(15)18-8-14(2)6-5-10-7-11(13(16)17)3-4-12(10)19-14/h3-7H,8H2,1-2H3,(H,16,17)/t14-/m0/s1
InChIKeyVJZZBDLJOJHQIR-AWEZNQCLSA-N
Species of MetaboliteComponentSourceComments
Neosartorya (ncbitaxon:36629) - PubMed (27438842)
ChEBI Ontology
Outgoing Relation(s)
Quadricinctapyran B (CHEBI:205797) is a 1-benzopyran (CHEBI:38443)
IUPAC Name 
(2S)-2-(acetyloxymethyl)-2-methylchromene-6-carboxylic acid
Manual XrefsDatabases
58197069ChemSpider