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docosanoate

Properties

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Occurences in reactions

MNX_ID

MNXM7102

	#reac
in my sandbox	0
in MNXref (generic)	24
in models (compartimentalized)	37

formula

C₂₂H₄₃O₂

charge

-1

mass

339.32685

reference

InChIKey

UKMSUNONTOPOIO-UHFFFAOYSA-M

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

SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:23858 chebi:23858	docosanoate CH3-[CH2]20-COO(-) Docosanoate behenate
bigg.metabolite:docosac biggM:docosac	Behenate, Docosanoate
lipidmaps:LMFA01010050 lipidmapsM:LMFA01010050	Behenic acid(d3) Docosanoic acid(d3)
hmdb:HMDB0000944	Behenic acid 1-Docosanoate 1-Docosanoic acid Behenate Behensaeure CH3-[CH2]20-COOH Docosanate Docosanic acid Docosanoate Docosanoic acid Docosansaeure Docosoate Docosoic acid Dokosansaeure FA(22:0) N-Docosanoate N-Docosanoic acid behenic acid docosanoic acid
lipidmaps:LMFA01010022 lipidmapsM:LMFA01010022	Behenic acid C22:0 FA 22:0 docosanoic acid
sabiork.compound:10380 sabiorkM:10380	Behenic acid Docosanoate Docosanoic acid
seed.compound:cpd05196 seedM:cpd05196	Docosanoate Behenic acid Docosanoic acid behenate behenic acid docosanoate docosanoic acid
kegg.compound:C08281 keggC:C08281	Docosanoic acid Behenic acid Docosanoate
metacyc.compound:DOCOSANOATE metacycM:DOCOSANOATE	behenate behenic acid docosanoate docosanoic acid
SLM:000000827 slm:000000827	docosanoate Behenate
CHEBI:28941 chebi:28941	docosanoic acid 1-docosanoic acid Behenic acid Behensaeure CH3-[CH2]20-COOH Docosanoate Docosanoic acid Docosansaeure Dokosansaeure Heneicosansaeure docosanic acid docosoic acid n-docosanoic acid
hmdb:HMDB00944 chebi:25463 chebi:3003 biggM:M_docosac keggC:M_C08281 seedM:M_cpd05196	secondary/obsolete/fantasy identifier