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CHEBI:220684 - Xylarphthalide A

ChEBI IDCHEBI:220684
ChEBI NameXylarphthalide A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC11H10O6
Net Charge0
Average Mass238.195
Monoisotopic Mass238.04774
SMILESC[C@@H](O)[C@@H]1OC(=O)c2c(O)ccc(C(=O)O)c21
InChIInChI=1S/C11H10O6/c1-4(12)9-7-5(10(14)15)2-3-6(13)8(7)11(16)17-9/h2-4,9,12-13H,1H3,(H,14,15)/t4-,9+/m1/s1
InChIKeyGYJYLNKUFQPNEA-MOFOKWOHSA-N
Species of MetaboliteComponentSourceComments
Xylaria (ncbitaxon:37991) - PubMed (28385040)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Xylarphthalide A (CHEBI:220684) is a 2-hydroxyisophthalic acid (CHEBI:19643)
IUPAC Name 
(3R)-7-hydroxy-3-[(1R)-1-hydroxyethyl]-1-oxo-3H-2-benzouran-4-carboxylic acid
Manual XrefsDatabases
78439557ChemSpider