CHEBI:27819 - clavaldehyde

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ChEBI Name clavaldehyde
Definition An organic heterobicyclic compound that is clavulanic acid in which the allylic alcohol group has been oxidised to the corresponding aldehyde.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:3735, CHEBI:23327
Supplier Information
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Formula C8H7NO5
Net Charge 0
Average Mass 197.14490
Monoisotopic Mass 197.03242
InChI InChI=1S/C8H7NO5/c10-2-1-4-7(8(12)13)9-5(11)3-6(9)14-4/h1-2,6-7H,3H2,(H,12,13)/b4-1-/t6-,7-/m1/s1
SMILES OC(=O)[C@@H]1N2[C@@H](CC2=O)O\C1=C/C=O
Metabolite of Species Details
Streptomyces clavuligerus (NCBI:txid1901) 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 clavaldehyde (CHEBI:27819) has role bacterial metabolite (CHEBI:76969)
clavaldehyde (CHEBI:27819) is a β-lactam (CHEBI:35627)
clavaldehyde (CHEBI:27819) is a enal (CHEBI:51688)
clavaldehyde (CHEBI:27819) is a organic heterobicyclic compound (CHEBI:27171)
clavaldehyde (CHEBI:27819) is a oxo monocarboxylic acid (CHEBI:35871)
clavaldehyde (CHEBI:27819) is conjugate acid of clavaldehyde(1−) (CHEBI:78625)
Incoming clavaldehyde(1−) (CHEBI:78625) is conjugate base of clavaldehyde (CHEBI:27819)
(2R,3Z,5R)-7-oxo-3-(2-oxoethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Synonyms Sources
(3R,5R)-clavulanate-9-aldehyde ChEBI
(3R,5R)-clavulanic acid-9-aldehyde ChEBI
Clavulanate-9-aldehyde KEGG COMPOUND
Manual Xrefs Databases
CPD-9260 MetaCyc
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Citations Waiting for Citations Types Sources
12426344 PubMed citation Europe PMC
17279617 PubMed citation Europe PMC
19941870 PubMed citation Europe PMC
Last Modified
12 August 2014