Mol:BMAXS2AMS502
From Metabolomics.JP
(Difference between revisions)
(New page: Copyright: ARM project http://www.metabolome.jp/ 18 18 0 0 1 0 0 0 0 0999 V2000 4.3179 0.4071 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6270 1.3582 ...) |
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| Line 39: | Line 39: | ||
4 10 1 1 0 0 0 | 4 10 1 1 0 0 0 | ||
7 18 2 0 0 0 0 | 7 18 2 0 0 0 0 | ||
| − | S SKP | + | S SKP 7 |
| − | NAME 5 | + | NAME [(2R,5R) -5- [(2-Aminoacetyl) amino] -3,4-dihydroxyoxolan-2-yl] methyl dihydrogen phosphate |
| + | CAS_RN 10074-18-7 | ||
ID BMAXS2AMS502 | ID BMAXS2AMS502 | ||
FORMULA C7H15N2O8P | FORMULA C7H15N2O8P | ||
EXACTMASS 286.05660197599997 | EXACTMASS 286.05660197599997 | ||
AVERAGEMASS 286.176441 | AVERAGEMASS 286.176441 | ||
| + | SMILES NCC(=O)N[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1 | ||
SMILES NCC(=O)N[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1 | SMILES NCC(=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/
18 18 0 0 1 0 0 0 0 0999 V2000
4.3179 0.4071 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.6270 1.3582 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.6270 1.3582 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.9360 0.4071 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.8870 0.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3669 0.0981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.1590 -0.8800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2079 -1.1891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.1672 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.1270 -0.1807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0392 2.1672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.2147 2.1672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.0949 -0.8800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.0460 -1.1891 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
8.3550 -0.2380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.7370 -2.1401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.9971 -1.4981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9021 -1.5492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3 12 1 6 0 0 0
4 3 1 0 0 0 0
5 13 1 0 0 0 0
3 2 1 0 0 0 0
13 14 1 0 0 0 0
14 15 1 0 0 0 0
1 6 1 0 0 0 0
14 16 1 0 0 0 0
2 1 1 0 0 0 0
14 17 2 0 0 0 0
4 5 1 0 0 0 0
6 7 1 0 0 0 0
1 10 1 1 0 0 0
7 8 1 0 0 0 0
2 11 1 6 0 0 0
8 9 1 0 0 0 0
4 10 1 1 0 0 0
7 18 2 0 0 0 0
S SKP 7
NAME [(2R,5R) -5- [(2-Aminoacetyl) amino] -3,4-dihydroxyoxolan-2-yl] methyl dihydrogen phosphate
CAS_RN 10074-18-7
ID BMAXS2AMS502
FORMULA C7H15N2O8P
EXACTMASS 286.05660197599997
AVERAGEMASS 286.176441
SMILES NCC(=O)N[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1
SMILES NCC(=O)N[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1
M END
