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CHEBI:81665 - Phthalate 3,4-cis-dihydrodiol

ChEBI IDCHEBI:81665
ChEBI NamePhthalate 3,4-cis-dihydrodiol
Stars
DownloadsMolfile
FormulaC8H8O6
Net Charge0
Average Mass200.146
Monoisotopic Mass200.03209
SMILESO=C(O)C1=C(C(=O)O)[C@@H](O)[C@@H](O)C=C1
InChIInChI=1S/C8H8O6/c9-4-2-1-3(7(11)12)5(6(4)10)8(13)14/h1-2,4,6,9-10H,(H,11,12)(H,13,14)/t4-,6-/m0/s1
InChIKeySBNAJYFFJXNDIG-NJGYIYPDSA-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)
Phthalate 3,4-cis-dihydrodiol (CHEBI:81665) is a 3-hydroxy carboxylic acid (CHEBI:61355)
Manual XrefsDatabases
C18314KEGG COMPOUND