CHEBI:132329 - 3,4,5-trihydroxy-1-cyclohexene-1-carboxylic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3,4,5-trihydroxy-1-cyclohexene-1-carboxylic acid
ChEBI ID CHEBI:132329
Definition A cyclohexenecarboxylic acid that is 1-cyclohexene-1-carboxylic acid carrying three hydroxy substituents at positions 3, 4 and 5.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C7H10O5
Net Charge 0
Average Mass 174.152
Monoisotopic Mass 174.05282
InChI InChI=1S/C7H10O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,4-6,8-10H,2H2,(H,11,12)
InChIKey JXOHGGNKMLTUBP-UHFFFAOYSA-N
SMILES C1=C(CC(C(C1O)O)O)C(=O)O
Metabolite of Species Details
Pseudomonas putida DOT-T1E (NCBI:txid1196325) See: MetaboLights Study
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
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ChEBI Ontology
Outgoing 3,4,5-trihydroxy-1-cyclohexene-1-carboxylic acid (CHEBI:132329) has role bacterial metabolite (CHEBI:76969)
3,4,5-trihydroxy-1-cyclohexene-1-carboxylic acid (CHEBI:132329) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020)
3,4,5-trihydroxy-1-cyclohexene-1-carboxylic acid (CHEBI:132329) is a cyclohexenecarboxylic acid (CHEBI:23483)
3,4,5-trihydroxy-1-cyclohexene-1-carboxylic acid (CHEBI:132329) is a hydroxy monocarboxylic acid (CHEBI:35868)
IUPAC Name
3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid
Manual Xref Database
1063 ChemSpider
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Registry Number Type Source
2210054 Reaxys Registry Number Reaxys
Last Modified
12 January 2017