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

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ChEBI Name Phthalate 3,4-cis-dihydrodiol
ChEBI ID CHEBI:81665
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C8H8O6
Net Charge 0
Average Mass 200.14550
Monoisotopic Mass 200.03209
InChI InChI=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
InChIKey SBNAJYFFJXNDIG-NJGYIYPDSA-N
SMILES O[C@H]1C=CC(C(O)=O)=C([C@H]1O)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing Phthalate 3,4-cis-dihydrodiol (CHEBI:81665) is a 3-hydroxy carboxylic acid (CHEBI:61355)
Manual Xref Database
C18314 KEGG COMPOUND
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