undecanoate (CHEBI:32369)

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CHEBI:32369 - undecanoate

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ChEBI ID	CHEBI:32369
ChEBI Name	undecanoate
Stars
Definition	A medium-chain fatty acid anion that is the conjugate base of undecanoic acid; used in tandem with testosterone cation in the treatment of male hypogonadism. Major species at pH 7.3.
Last Modified	11 December 2014
Submitter	Kirill Degtyarenko
Downloads	Molfile

Formula	C11H21O2
Net Charge	-1
Average Mass	185.287
Monoisotopic Mass	185.15470
SMILES	CCCCCCCCCCC(=O)[O-]
InChI	InChI=1S/C11H22O2/c1-2-3-4-5-6-7-8-9-10-11(12)13/h2-10H2,1H3,(H,12,13)/p-1
InChIKey	ZDPHROOEEOARMN-UHFFFAOYSA-M

Roles Classification

Biological Role:

human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).

ChEBI Ontology

Outgoing Relation(s)
	undecanoate (CHEBI:32369) has role human metabolite (CHEBI:77746)
	undecanoate (CHEBI:32369) is a medium-chain fatty acid anion (CHEBI:59558)
	undecanoate (CHEBI:32369) is a straight-chain saturated fatty acid anion (CHEBI:58954)
	undecanoate (CHEBI:32369) is conjugate base of undecanoic acid (CHEBI:32368)
Incoming Relation(s)
Incoming Relation(s)	undecanoic acid (CHEBI:32368) is conjugate acid of undecanoate (CHEBI:32369)

IUPAC Name
undecanoate

Synonyms	Source
CH₃‒[CH₂]₉‒COO⁻	IUPAC
undecylate	ChEBI
n-undecoate	ChEBI
undecoate	ChEBI
n-undecylate	ChEBI
1-decanecarboxylate	ChEBI

UniProt Name	Source
undecanoate	UniProt

Registry Numbers	Sources
Gmelin:331364	Gmelin
Beilstein:3904444	Beilstein

Citations