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CHEBI:182408 - (3'S,4'R)-3',4',5'-Trihydroxy-8-oxospiro[6,7-dihydronaphthalene-5,2'-oxolane]-2-carboxylic acid

ChEBI IDCHEBI:182408
ChEBI Name(3'S,4'R)-3',4',5'-Trihydroxy-8-oxospiro[6,7-dihydronaphthalene-5,2'-oxolane]-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H14O7
Net Charge0
Average Mass294.259
Monoisotopic Mass294.07395
SMILESO=C(O)c1ccc2c(c1)C(=O)CCC21OC(O)[C@H](O)[C@@H]1O
InChIInChI=1S/C14H14O7/c15-9-3-4-14(11(17)10(16)13(20)21-14)8-2-1-6(12(18)19)5-7(8)9/h1-2,5,10-11,13,16-17,20H,3-4H2,(H,18,19)/t10-,11+,13?,14?/m1/s1
InChIKeyBAUPPZJHTWBQAS-UJLSLHKQSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(3'S,4'R)-3',4',5'-Trihydroxy-8-oxospiro[6,7-dihydronaphthalene-5,2'-oxolane]-2-carboxylic acid (CHEBI:182408) is a naphthoic acid (CHEBI:25483)
IUPAC Name 
(3'S,4'R)-3',4',5'-trihydroxy-8-oxospiro[6,7-dihydronaphthalene-5,2'-oxolane]-2-carboxylic acid
Manual XrefsDatabases
30791720ChemSpider
C17017KEGG COMPOUND