KEGG   COMPOUND: C01181Help
Entry
C01181                      Compound                               

Name
4-Trimethylammoniobutanoate;
Butyro-betaine;
gamma-Butyrobetaine
Formula
C7H16NO2
Exact mass
146.1181
Mol weight
146.2074
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00310  Lysine degradation
map01100  Metabolic pathways
map02010  ABC transporters
Enzyme
1.2.1.3         1.2.1.47        1.14.11.1       2.8.3.21
Other DBs
PubChem: 4408
ChEBI: 1941
ChEMBL: CHEMBL2074645
PDB-CCD: NM2[PDBj]
3DMET: B00256
NIKKAJI: J38.536K
LinkDB All DBs
KCF data Show

ATOM        10
            1   N1d N    30.7300  -25.4800 #+
            2   C1b C    29.6100  -26.1100
            3   C1a C    32.2000  -26.1800
            4   C1a C    30.7300  -23.8000
            5   C1a C    32.4800  -24.9200
            6   C1b C    28.4900  -25.4800
            7   C1b C    27.3700  -26.1100
            8   C6a C    26.2500  -25.4800
            9   O6a O    25.1300  -26.1100
            10  O6a O    26.2500  -24.2200
BOND        9
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1
            5     2   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     8  10 2

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