Mol:BMAAS6ANe002
From Metabolomics.JP
(Difference between revisions)
| (One intermediate revision by one user not shown) | |||
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 15 14 0 0 1 0 0 0 0 0999 V2000 | + | 15 14 0 0 1 0 0 0 0 0999 V2000 |
| − | 7.1962 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 0.9330 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 6.3301 0.9330 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 0.4330 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 3.7321 0.4330 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 1.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 1.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 1.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 1.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.1962 -0.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 -0.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.0622 0.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0622 0.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -0.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -0.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -1.0670 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -1.0670 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3660 -0.2010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3660 -0.2010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -1.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -1.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3660 -1.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3660 -1.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2 7 1 6 0 0 0 | + | 2 7 1 6 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
| − | 1 9 2 0 0 0 0 | + | 1 9 2 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 4 3 1 0 0 0 0 | + | 4 3 1 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 6 8 1 0 0 0 0 | + | 6 8 1 0 0 0 0 |
| − | 1 10 1 0 0 0 0 | + | 1 10 1 0 0 0 0 |
| − | 5 11 1 4 0 0 0 | + | 5 11 1 4 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
| − | 12 15 1 0 0 0 0 | + | 12 15 1 0 0 0 0 |
| − | 12 14 2 0 0 0 0 | + | 12 14 2 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMAAS6ANe002 | + | ID BMAAS6ANe002 |
| − | NAME | + | NAME (2S) -2,6-Diamino-5-phosphonooxyhexanoic acid |
| − | FORMULA C6H15N2O6P | + | CAS_RN 32163-95-4 |
| − | EXACTMASS 242.0667 | + | FORMULA C6H15N2O6P |
| − | AVERAGEMASS 242.1669 | + | EXACTMASS 242.0667 |
| − | SMILES NCC(CC[C@H](N)C(O)=O)OP(O)(O)=O | + | AVERAGEMASS 242.1669 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03366 | + | SMILES NCC(CC[C@H](N)C(O)=O)OP(O)(O)=O |
| + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03366 | ||
M END | M END | ||
| − | |||
Latest revision as of 17:00, 11 June 2010
Copyright: ARM project http://www.metabolome.jp/
15 14 0 0 1 0 0 0 0 0999 V2000
7.1962 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.9330 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
5.4641 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 0.4330 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
2.8660 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -0.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 0.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -0.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.0670 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
2.3660 -0.2010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3660 -1.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 7 1 6 0 0 0
2 1 1 0 0 0 0
1 9 2 0 0 0 0
2 3 1 0 0 0 0
4 3 1 0 0 0 0
5 6 1 0 0 0 0
4 5 1 0 0 0 0
6 8 1 0 0 0 0
1 10 1 0 0 0 0
5 11 1 4 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
12 15 1 0 0 0 0
12 14 2 0 0 0 0
S SKP 7
ID BMAAS6ANe002
NAME (2S) -2,6-Diamino-5-phosphonooxyhexanoic acid
CAS_RN 32163-95-4
FORMULA C6H15N2O6P
EXACTMASS 242.0667
AVERAGEMASS 242.1669
SMILES NCC(CC[C@H](N)C(O)=O)OP(O)(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03366
M END
