Mol:BMAXS5ANj007
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
19 18 0 0 1 0 0 0 0 0999 V2000
8.0622 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
6.3301 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
13 12 1 0 0 0 0
11 6 1 0 0 0 0
11 17 2 0 0 0 0
12 11 1 0 0 0 0
14 19 1 0 0 0 0
14 18 2 0 0 0 0
13 14 1 0 0 0 0
2 6 1 1 0 0 0
2 1 1 0 0 0 0
1 15 2 0 0 0 0
2 3 1 0 0 0 0
4 3 1 0 0 0 0
4 5 1 0 0 0 0
5 7 1 0 0 0 0
8 10 2 0 0 0 0
8 9 1 0 0 0 0
7 8 1 0 0 0 0
1 16 1 0 0 0 0
S SKP 7
ID BMAXS5ANj007
NAME (2S) -5- (Diaminomethylideneamino) -2- [(4-hydroxy-4-oxobutanoyl) amino] pentanoic acid
CAS_RN 2478-02-6
FORMULA C10H18N4O5
EXACTMASS 274.1277
AVERAGEMASS 274.2738
SMILES NC(=N)NCCC[C@H](NC(=O)CCC(O)=O)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03296
M END
