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CHEBI
Chemical Entities of Biological Interest Ontology
(CHEBI)
OBO
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Last submission date May 11, 2023
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ID
http://purl.obolibrary.org/obo/CHEBI_17128
http://purl.obolibrary.org/obo/CHEBI_17128
https://biodivportal.gfbio.org/ontologies/CHEBI/CHEBI_17128
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Preferred name
adipate(2-)
Synonyms
hexan-1,6-dicarboxylate
O2C(CH2)4CO2 dianion
hexanedioic acid, ion(2-)
hexanedioate
adipate dianion
Definitions
A dicarboxylic acid dianion obtained by the deprotonation of both the carboxy groups of adipic acid.
Raw data
oboinowl_gen:hasAlternativeId
CHEBI:22264
CHEBI:13744
oboinowl_gen:inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
obo_purl:smiles
[O-]C(=O)CCCCC([O-])=O
obo_purl:charge
-2
obo_purl:inchikey
WNLRTRBMVRJNCN-UHFFFAOYSA-L
obo_purl:RO_0000087
http://purl.obolibrary.org/obo/CHEBI_76967
oboinowl_gen:hasDbXref
Gmelin:326743
Beilstein:3904826
Reaxys:3904826
CAS:764-65-8
MetaCyc:ADIPATE
UM-BBD_compID:c0123
obo_purl:IAO_0000115
A dicarboxylic acid dianion obtained by the deprotonation of both the carboxy groups of adipic acid.
skos:notation
CHEBI:17128
oboinowl_gen:hasExactSynonym
hexanedioate
obo_purl:mass
144.12532
obo_purl:inchi
InChI=1S/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10)/p-2
obo_purl:formula
C6H8O4
oboinowl_gen:hasOBONamespace
chebi_ontology
obo_purl:is_conjugate_base_of
http://purl.obolibrary.org/obo/CHEBI_30833
rdf:type
http://www.w3.org/2002/07/owl#Class
oboinowl_gen:hasRelatedSynonym
hexan-1,6-dicarboxylate
O2C(CH2)4CO2 dianion
hexanedioic acid, ion(2-)
hexanedioate
adipate dianion
oboinowl_gen:id
CHEBI:17128
rdfs:label
adipate(2-)
obo_purl:monoisotopicmass
144.04336
rdfs:subClassOf
http://purl.obolibrary.org/obo/CHEBI_133291
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