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Carnitine [461-06-3]

 
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Identification
Copyright
CAS # 461-06-3, Carnitine
Name
Carnitine
Synonyms
3-Hydroxy-4-Trimethylammonio-Butanoate; 3-Hydroxy-4-Trimethylammoniobutanoate; 3-Hydroxy-4-Trimethylammonio-Butyrate
Molecular Formula
C7H15NO3
Molecular Weight 161.20
CAS Registry Number
461-06-3
SMILES
C([N+](C)(C)C)C(CC(=O)[O-])O
InChI
1S/C7H15NO3/c1-8(2,3)5-6(9)4-7(10)11/h6,9H,4-5H2,1-3H3
InChIKey PHIQHXFUZVPYII-UHFFFAOYSA-N
down References
(1) Suresh Selvarasu, Iftekhar A. Karimi, Ghi-Hoon Ghim and Dong-Yup Lee. Genome-scale modeling and in silico analysis of mouse cell metabolic network, Mol. Biosyst., 2010, 6, 152.
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