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sodium octanoate

PropertiesImage
MNX_IDMNXM161114 Image of MNXM161114
referencechebi:132100
formulaC8H15NaO2
global charge0
mol weight166.196
InChIKeyBYKRNSHANADUFY-UHFFFAOYSA-M
InChIInChI=1S/C8H16O2.Na/c1-2-3-4-5-6-7-8(9)10;/h2-7H2,1H3,(H,9,10);/q;+1/p-1
SMILESCCCCCCCC(=O)[O-].[Na+]
MNX internals
InChI (mnx)InChI=1/C8H16O2.Na/c1-2-3-4-5-6-7-8(9)10;/h2-7H2,1H3,(H,9,10);/q;+1 Image of MNXM161114
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][C:8](=[O:9])[OH:10].[Na+:11]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:132100
chebi:132100
BYKRNSHANADUFY-UHFFFAOYSA-M 		sodium octanoate
Caprylic acid sodium salt
Natrium octanoat
Octanoic acid, sodium salt
Sodium caprylate
Sodium n-octanoate

kegg.drug:D08999
keggD:D08999
BYKRNSHANADUFY-UHFFFAOYSA-M 		Sodium caprylate (NF)

seed.compound:cpd30664
seedM:cpd30664 		Sodium octanoate

keggD:M_D08999
seedM:M_cpd30664 		secondary/obsolete/fantasy identifier