CHEBI:23858 - behenate

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ChEBI Name behenate
ChEBI ID CHEBI:23858
Definition A straight-chain saturated fatty acid anion that is the conjugate base of behenic acid, arising from deprotonation of the carboxylic acid group.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C22H43O2
Net Charge -1
Average Mass 339.57560
Monoisotopic Mass 339.32685
InChI InChI=1S/C22H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h2-21H2,1H3,(H,23,24)/p-1
InChIKey UKMSUNONTOPOIO-UHFFFAOYSA-M
SMILES CCCCCCCCCCCCCCCCCCCCCC([O-])=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
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ChEBI Ontology
Outgoing behenate (CHEBI:23858) has role human metabolite (CHEBI:77746)
behenate (CHEBI:23858) is a ω-methyl fatty acid anion (CHEBI:76619)
behenate (CHEBI:23858) is a 2-saturated fatty acid anion (CHEBI:83955)
behenate (CHEBI:23858) is a fatty acid anion 22:0 (CHEBI:78127)
behenate (CHEBI:23858) is a long-chain fatty acid anion (CHEBI:57560)
behenate (CHEBI:23858) is a straight-chain saturated fatty acid anion (CHEBI:58954)
behenate (CHEBI:23858) is conjugate base of docosanoic acid (CHEBI:28941)
Incoming 13-(β-D-glucosyloxy)docosanoate (CHEBI:36487) has functional parent behenate (CHEBI:23858)
13-hydroxydocosanoate (CHEBI:11320) has functional parent behenate (CHEBI:23858)
2-hydroxybehenate (CHEBI:76722) has functional parent behenate (CHEBI:23858)
N-docosanoyl-3-ketodihydrosphingosine (CHEBI:189542) has functional parent behenate (CHEBI:23858)
N-docosanoyltaurine(1−) (CHEBI:146196) has functional parent behenate (CHEBI:23858)
docosanoic acid (CHEBI:28941) is conjugate acid of behenate (CHEBI:23858)
IUPAC Name
docosanoate
Synonyms Sources
behenate CBN
CH3‒[CH2]20‒COO− IUPAC
docosanoate UniProt
Docosanoate KEGG COMPOUND
Manual Xref Database
C08281 KEGG COMPOUND
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Registry Number Type Source
351197 Gmelin Registry Number Gmelin
Last Modified
08 March 2017