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Environmental conditions, treatments and exposures ontology
Last uploaded:
February 14, 2023
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| Id | http://purl.obolibrary.org/obo/CHEBI_16150
http://purl.obolibrary.org/obo/CHEBI_16150
|
|---|---|
| Preferred Name | benzoate |
| Definitions |
The simplest member of the class of benzoates that is the conjugate base of benzoic acid, comprising a benzoic acid core with a proton missing to give a charge of -1.
|
| Synonyms |
Benzenecarboxylate
Phenylformate
Benzeneformate
Benzenemethanoate
benzoic acid, ion(1-)
benzoate anion
Phenylcarboxylate
benzoate
|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| label |
benzoate
|
|---|---|
| prefLabel |
benzoate
|
| xRef |
MetaCyc:BENZOATE
KEGG:C00180
CAS:766-76-7
Reaxys:1862486
UM-BBD_compID:c0121
Beilstein:1862486
HMDB:HMDB0001870
Gmelin:2945
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|
| notation |
CHEBI:16150
|
| inSubset | |
| inchi |
InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/p-1
|
| hasRelatedSynonym |
Benzenecarboxylate
Phenylformate
Benzeneformate
Benzenemethanoate
benzoic acid, ion(1-)
benzoate anion
Phenylcarboxylate
See more
See less
|
| id |
CHEBI:16150
|
| charge |
-1
|
| hasOBONamespace |
chebi_ontology
|
| textual definition |
The simplest member of the class of benzoates that is the conjugate base of benzoic acid, comprising a benzoic acid core with a proton missing to give a charge of -1.
|
| formula |
C7H5O2
|
| subClassOf | |
| is conjugate base of | |
| inchikey |
WPYMKLBDIGXBTP-UHFFFAOYSA-M
|
| mass |
121.11340
|
| monoisotopicmass |
121.02950
|
| hasAlternativeId |
CHEBI:13879
CHEBI:22717
|
| type | |
| smiles |
[O-]C(=O)c1ccccc1
|
| has role | |
| has exact synonym |
benzoate
|
| bearer of |
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