Decanoylcarnitine

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Systematic / IUPAC Name: (3-Carboxy-2-decanoyloxypropyl)-trimethylazanium

ID: Reference882

Other Names: 3-(Decanoyloxy)-4-(trimethylammonio)butanoate;
2-[1-Hydroxy-2-(trimethylazaniumyl)ethyl]-3-oxododecanoate;
O-Decanoylcarnitine

Formula: C17H34NO4 +

Class: Endogenous Metabolites

Spectral Data

Decanoylcarnitine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 94
Tandem Spectra MS1, MS2, MS3
Ionization Methods ESI
Analyzers FT
Last Modification 3/24/2015 9:46:28 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C17H33NO4/c1-5-6-7-8-9-10-11-12-17(21)22-15(13-16(19)20)14-18(2,3)4/h15H,5-14H2,1-4H3/p+1
InChI Key LZOSYCMHQXPBFU-UHFFFAOYSA-O
Canonical SMILES CCCCCCCCCC(=O)OC(CC(=O)O)C[N+](C)(C)C
CAS 1492279
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Other Names 3-(Decanoyloxy)-4-(trimethylammonio)butanoate;
2-[1-Hydroxy-2-(trimethylazaniumyl)ethyl]-3-oxododecanoate;
O-Decanoylcarnitine

In Other Databases

HMDb HMDB00651
ChemSpider 2579902
ChEBI CHEBI:68830
PubChem 10245190