Mol:BMFYB4CAb018
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
11 10 0 0 1 0 0 0 0 0999 V2000
4.5981 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 0.1830 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
3.7321 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.3170 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
2.3660 -0.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3660 -2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.8170 0.0000 C 0 3 0 0 0 0 0 0 0 0 0 0
3.7321 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3 4 1 0 0 0 0
3 11 1 6 0 0 0
3 2 1 0 0 0 0
4 5 1 0 0 0 0
1 9 1 0 0 0 0
5 6 1 0 0 0 0
1 10 2 0 0 0 0
5 7 1 0 0 0 0
2 1 1 0 0 0 0
5 8 1 0 0 0 0
S SKP 6
ID BMFYB4CAb018
NAME D-Carnitine
FORMULA C7H15NO3
EXACTMASS 161.1051
AVERAGEMASS 161.1989
SMILES OC(=O)C[C@@H](O)C[N+1](C)(C)[CH2+1]
M END
