Mol:
14007-45-5.mol by:chem960.com
ChemDraw08031019472D
…………
0 0
5.4386 3.9250 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0
4.0790 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.8916 1.9625 0.0000 K 0 3 0 0 0 0 0 0 0 0 0 0
10.9850 1.9625 0.0000 K 0 3 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
2 4 1 0 0 0 0
5 4 1 1 0 0 0
5 6 1 0 0 0 0
6 7 2 0 0 0 0
6 8 1 0 0 0 0
5 9 1 0 0 0 0
M CHG 1 1 -1
M CHG 1 8 -1
M CHG 1 10 1
M CHG 1 11 1
M END
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L-天门冬氨酸钾 InChIKey: IKALZAKZWHFNIC-JIZZDEOASA-L
L-天门冬氨酸钾 Inchi: 1S/C4H7NO4.K/c5-2(4(8)9)1-3(6)7;/h2H,1,5H2,(H,6,7)(H,8,9);/q;+1/p-1/t2-;/m0./s1
L-天门冬氨酸钾 SMILES: [O-]C(C[C@H](N)C([O-])=O)=O.[K+].[K+]