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3-dehydrocarnitine

Properties

Image

Occurences in reactions

MNX_ID

MNXM1637

	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	1

formula

C₇H₁₃NO₃

charge

mass

159.08954

reference

InChIKey

YNOWULSFLVIUDH-UHFFFAOYSA-N

InChI

InChI=1S/C7H13NO3/c1-8(2,3)5-6(9)4-7(10)11/h4-5H2,1-3H3

SMILES

C[N+](C)(C)CC(=O)CC(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57885 chebi:57885	3-dehydrocarnitine 3-oxo-4-(trimethylammonio)butanoate 3-oxo-4-(trimethylazaniumyl)butanoate
sabiork.compound:2474 sabiorkM:2474 kegg.compound:C02636 keggC:C02636	3-Dehydrocarnitine 3-Carboxy-N,N,N-trimethyl-2-oxo-1-propanaminium
hmdb:HMDB0012154	3-Dehydrocarnitine 3-Carboxy-N,N,N-trimethyl-2-oxo-1-propanaminium 3-Carboxy-N,N,N-trimethyl-2-oxopropan-1-aminium 3-dehydrocarnitine 3-oxo-4-(Trimethylammonio)butanoate 3-oxo-4-(Trimethylammonio)butanoic acid 3-oxo-4-(trimethylazaniumyl)butanoate
seed.compound:cpd01715 seedM:cpd01715	3-Dehydrocarnitine 3-Carboxy-N,N,N-trimethyl-2-oxo-1-propanaminium 3-de-H-carnitine 3-dehydrocarnitine
metacyc.compound:3-DE-H-CARNITINE metacycM:3-DE-H-CARNITINE	3-dehydrocarnitine 3-de-H-carnitine
CHEBI:16758 chebi:16758	3-dehydrocarnitinium 3-Carboxy-N,N,N-trimethyl-2-oxo-1-propanaminium 3-Dehydrocarnitine 3-carboxy-N,N,N-trimethyl-2-oxo-1-propanaminium 3-carboxy-N,N,N-trimethyl-2-oxopropan-1-aminium
hmdb:HMDB12154 chebi:11779 chebi:1485 chebi:19995 keggC:M_C02636 seedM:M_cpd01715	secondary/obsolete/fantasy identifier