Mol:BMAXS2AMS503
From Metabolomics.JP
(Difference between revisions)
(New page: Copyright: ARM project http://www.metabolome.jp/ 20 20 0 0 1 0 0 0 0 0999 V2000 5.4769 1.0507 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7859 2.0018 ...) |
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| Line 43: | Line 43: | ||
4 3 1 0 0 0 0 | 4 3 1 0 0 0 0 | ||
10 20 2 0 0 0 0 | 10 20 2 0 0 0 0 | ||
| − | S SKP | + | S SKP 7 |
| − | NAME 5 | + | NAME [(2R,5R) -5- [(2-Formamidoacetyl) amino] -3,4-dihydroxyoxolan-2-yl] methyldihydrogen phosphate |
| + | CAS_RN 349-34-8 | ||
ID BMAXS2AMS503 | ID BMAXS2AMS503 | ||
FORMULA C8H15N2O9P | FORMULA C8H15N2O9P | ||
EXACTMASS 314.051516598 | EXACTMASS 314.051516598 | ||
AVERAGEMASS 314.18654100000003 | AVERAGEMASS 314.18654100000003 | ||
| + | SMILES O=CNCC(=O)N[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1 | ||
SMILES O=CNCC(=O)N[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1 | SMILES O=CNCC(=O)N[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1 | ||
M END | M END | ||
Latest revision as of 17:09, 11 June 2010
Copyright: ARM project http://www.metabolome.jp/
20 20 0 0 1 0 0 0 0 0999 V2000
5.4769 1.0507 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
5.7859 2.0018 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.7859 2.0018 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
7.0949 1.0507 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
8.0460 0.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5258 0.7417 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.3179 -0.2365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3669 -0.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1590 -1.5236 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.2079 -1.8326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2859 0.4629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1981 2.8108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.3737 2.8108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.2539 -0.2365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.2050 -0.5455 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
9.5140 0.4056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.8959 -1.4965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.1560 -0.8545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0611 -0.9056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.8108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5 14 1 0 0 0 0
3 2 1 0 0 0 0
14 15 1 0 0 0 0
15 16 1 0 0 0 0
1 6 1 0 0 0 0
15 17 1 0 0 0 0
2 1 1 0 0 0 0
15 18 2 0 0 0 0
4 5 1 0 0 0 0
6 7 1 0 0 0 0
1 11 1 1 0 0 0
7 8 1 0 0 0 0
2 12 1 6 0 0 0
8 9 1 0 0 0 0
4 11 1 1 0 0 0
7 19 2 0 0 0 0
3 13 1 6 0 0 0
9 10 1 0 0 0 0
4 3 1 0 0 0 0
10 20 2 0 0 0 0
S SKP 7
NAME [(2R,5R) -5- [(2-Formamidoacetyl) amino] -3,4-dihydroxyoxolan-2-yl] methyldihydrogen phosphate
CAS_RN 349-34-8
ID BMAXS2AMS503
FORMULA C8H15N2O9P
EXACTMASS 314.051516598
AVERAGEMASS 314.18654100000003
SMILES O=CNCC(=O)N[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1
SMILES O=CNCC(=O)N[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1
M END
