CHEBI:48968 - (2S,3S)-2,3-dihydroxy-2,3-dihydrobenzoic acid

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ChEBI Name (2S,3S)-2,3-dihydroxy-2,3-dihydrobenzoic acid
ChEBI ID CHEBI:48968
ChEBI ASCII Name (2S,3S)-2,3-dihydroxy-2,3-dihydrobenzoic acid
Definition The (2S,3S)-diastereomer of 2,3-dihydroxy-2,3-dihydrobenzoic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C7H8O4
Net Charge 0
Average Mass 156.13602
Monoisotopic Mass 156.042
InChI InChI=1S/C7H8O4/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3,5-6,8-9H,(H,10,11)/t5-,6-/m0/s1
InChIKey INCSWYKICIYAHB-WDSKDSINSA-N
SMILES O[C@H]1C=CC=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 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (2S,3S)-2,3-dihydroxy-2,3-dihydrobenzoic acid (CHEBI:48968) is a 2,3-dihydroxy-2,3-dihydrobenzoic acid (CHEBI:15941)
(2S,3S)-2,3-dihydroxy-2,3-dihydrobenzoic acid (CHEBI:48968) is conjugate acid of (2S,3S)-2,3-dihydroxy-2,3-dihydrobenzoate (CHEBI:58764)
(2S,3S)-2,3-dihydroxy-2,3-dihydrobenzoic acid (CHEBI:48968) is enantiomer of (2R,3R)-2,3-dihydroxy-2,3-dihydrobenzoic acid (CHEBI:48969)
Incoming (2S,3S)-2,3-dihydroxy-2,3-dihydrobenzoate (CHEBI:58764) is conjugate base of (2S,3S)-2,3-dihydroxy-2,3-dihydrobenzoic acid (CHEBI:48968)
(2R,3R)-2,3-dihydroxy-2,3-dihydrobenzoic acid (CHEBI:48969) is enantiomer of (2S,3S)-2,3-dihydroxy-2,3-dihydrobenzoic acid (CHEBI:48968)
IUPAC Name
(5S,6S)-5,6-dihydroxycyclohexa-1,3-diene-1-carboxylic acid
Database Links Databases
C00000737 KNApSAcK
C04171 KEGG COMPOUND
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Registry Number Type Source
2937647 Beilstein Registry Number Beilstein
Last Modified
21 January 2016