The Drug Ontology

Last uploaded: March 3, 2024
Preferred Name

Clavulanate

Synonyms

clavulanate

(2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate

(2R,5R,Z)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-aza-bicyclo[3.2.0]heptane-2-carboxylate

clavulanic acid anion

Definitions

The conjugate base of clavulanic acid.

ID

http://purl.obolibrary.org/obo/CHEBI_487869

charge

-1

database_cross_reference

PMID:25492589

definition

The conjugate base of clavulanic acid.

formula

C8H8NO5

has_exact_synonym

clavulanate

(2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate

has_obo_namespace

chebi_ontology

has_related_synonym

(2R,5R,Z)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-aza-bicyclo[3.2.0]heptane-2-carboxylate

clavulanic acid anion

has_RxCUI

48203

id

CHEBI:487869

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

inchi

InChI=1S/C8H9NO5/c10-2-1-4-7(8(12)13)9-5(11)3-6(9)14-4/h1,6-7,10H,2-3H2,(H,12,13)/p-1/b4-1-/t6-,7-/m1/s1

inchikey

HZZVJAQRINQKSD-PBFISZAISA-M

is conjugate base of

http://purl.obolibrary.org/obo/CHEBI_48947

label

Clavulanate

clavulanate

mass

198.15280

monoisotopicmass

198.04080

notation

CHEBI:487869

prefLabel

Clavulanate

smiles

[H][C@@]12CC(=O)N1[C@@H](C([O-])=O)\C(O2)=C\CO

subClassOf

http://purl.obolibrary.org/obo/CHEBI_35757

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