KEGG   COMPOUND: C00487
Entry
C00487                      Compound                               
Name
Carnitine;
gamma-Trimethyl-hydroxybutyrobetaine;
3-Hydroxy-4-trimethylammoniobutanoate
Formula
C7H16NO3
Exact mass
162.113
Mol weight
162.2068
Structure
Reaction
Pathway
map00310  Lysine degradation
map01100  Metabolic pathways
map02010  ABC transporters
Enzyme
1.1.1.108       1.14.11.1       2.3.1.7         4.1.1.42
Brite
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   Carnitine
    C00487  Carnitine
Other DBs
CAS: 406-76-8
PubChem: 3770
ChEBI: 17126 3424
3DMET: B04687
NIKKAJI: J334.275A
KCF data

ATOM        11
            1   O6a O    25.0600  -26.0400
            2   C6a C    26.2500  -25.3400
            3   C1b C    27.4400  -26.0400
            4   C1c C    28.7000  -25.3400
            5   C1b C    29.8900  -26.0400
            6   O6a O    26.2500  -23.9400
            7   O1a O    28.7000  -23.9400
            8   N1d N    31.0800  -25.2700 #+
            9   C1a C    32.4100  -26.1100
            10  C1a C    31.0800  -23.6600
            11  C1a C    32.7600  -24.7800
BOND        10
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     2   6 2
            6     4   7 1 #Either
            7     5   8 1
            8     8   9 1
            9     8  10 1
            10    8  11 1

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