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3-oxooctanoic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM14629

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₈H₁₄O₃

charge

mass

158.09429

reference

InChIKey

FWNRRWJFOZIGQZ-UHFFFAOYSA-N

InChI

InChI=1S/C8H14O3/c1-2-3-4-5-7(9)6-8(10)11/h2-6H2,1H3,(H,10,11)

SMILES

CCCCCC(=O)CC(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:44680 chebi:44680	3-oxooctanoic acid 3-Ketooctanoic acid 3-keto-n-caprylic acid beta-ketocaprylic acid beta-ketooctanoic acid beta-oxocaprylic acid beta-oxooctanoic acid
hmdb:HMDB0010721	3-Oxooctanoic acid 3-Keto-N-caprylate 3-Keto-N-caprylic acid 3-Ketooctanoate 3-Ketooctanoic acid 3-Oxooctanoate 3-oxo-Octanoate 3-oxo-Octanoic acid 3-oxooctanoic acid b-Ketocaprylate b-Ketocaprylic acid b-Ketooctanoate b-Ketooctanoic acid b-Oxocaprylate b-Oxocaprylic acid b-Oxooctanoate b-Oxooctanoic acid beta-Ketocaprylate beta-Ketocaprylic acid beta-Ketooctanoate beta-Ketooctanoic acid beta-Oxocaprylate beta-Oxocaprylic acid beta-Oxooctanoate beta-Oxooctanoic acid beta-ketocaprylate beta-ketocaprylic acid beta-ketooctanoate beta-ketooctanoic acid beta-oxocaprylate beta-oxocaprylic acid beta-oxooctanoate beta-oxooctanoic acid
lipidmaps:LMFA01060017 lipidmapsM:LMFA01060017	3-keto-n-caprylic acid 3-oxo-octanoic acid FA 8:1 O
metacyc.compound:CPD-10799 metacycM:CPD-10799 seed.compound:cpd22823 seedM:cpd22823	3-oxooctanoate 3-oxooctanoic acid
hmdb:HMDB10721 chebi:37106 chebi:44675 seedM:M_cpd22823	secondary/obsolete/fantasy identifier