CHEBI:137659 - 3-[(1R,4R)-4-hydroxycyclohex-2-en-1-yl]pyruvic acid

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ChEBI Name 3-[(1R,4R)-4-hydroxycyclohex-2-en-1-yl]pyruvic acid
ChEBI ID CHEBI:137659
ChEBI ASCII Name 3-[(1R,4R)-4-hydroxycyclohex-2-en-1-yl]pyruvic acid
Definition A tetrahydro-4-hydroxyphenylpyruvic acid with (1R,4R)-stereochemistry.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C9H12O4
Net Charge 0
Average Mass 184.190
Monoisotopic Mass 184.07356
InChI InChI=1S/C9H12O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1,3,6-7,10H,2,4-5H2,(H,12,13)/t6-,7+/m1/s1
InChIKey ABMPOYCAXJZJJB-RQJHMYQMSA-N
SMILES [C@@H]1(C=C[C@H](CC1)CC(=O)C(=O)O)O
Metabolite of Species Details
Bacillus subtilis (NCBI:txid1423) See: PubMed
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3-[(1R,4R)-4-hydroxycyclohex-2-en-1-yl]pyruvic acid (CHEBI:137659) has role bacterial metabolite (CHEBI:76969)
3-[(1R,4R)-4-hydroxycyclohex-2-en-1-yl]pyruvic acid (CHEBI:137659) is a tetrahydro-4-hydroxyphenylpyruvic acid (CHEBI:64808)
3-[(1R,4R)-4-hydroxycyclohex-2-en-1-yl]pyruvic acid (CHEBI:137659) is conjugate acid of 3-[(1R,4R)-4-hydroxycyclohex-2-en-1-yl]pyruvate (CHEBI:136783)
Incoming 3-[(1R,4R)-4-hydroxycyclohex-2-en-1-yl]pyruvate (CHEBI:136783) is conjugate base of 3-[(1R,4R)-4-hydroxycyclohex-2-en-1-yl]pyruvic acid (CHEBI:137659)
IUPAC Name
3-[(1R,4R)-4-hydroxycyclohex-2-en-1-yl]-2-oxopropanoic acid
Synonyms Sources
(1R,4R)-tetrahydro-4-hydroxyphenylpyruvic acid ChEBI
4R-H4HPP ChEBI
Manual Xref Database
CPD-17512 MetaCyc
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Citation Waiting for Citations Type Source
22765234 PubMed citation Europe PMC
Last Modified
05 July 2017