Mol:BMMCPYURS501
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 34 36 0 0 1 0 0 0 0 0999 V2000 4.0823 3.0567 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3913 4.0078 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5823 4.5956 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7733 4.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 5.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9170 -2.4046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0510 -2.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0510 -3.9046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9170 -4.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7830 -3.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7830 -2.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9170 -1.4046 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7260 -0.8168 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.4170 0.1343 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4170 0.1343 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.8292 0.9433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 2.2477 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3424 4.3168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 5.4046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0823 3.0567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.3001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1850 -2.4046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9170 -5.4046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7260 -0.8168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0048 0.9433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1080 -0.8168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8347 0.8387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2469 1.6478 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 8.0559 2.2355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4379 1.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6591 2.4568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6646 2.3522 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 5.7691 1.3577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5601 3.3468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 22 2 0 0 0 0 11 10 2 0 0 0 0 8 9 1 0 0 0 0 9 23 2 0 0 0 0 10 9 1 0 0 0 0 12 6 1 0 0 0 0 14 13 1 0 0 0 0 2 1 1 0 0 0 0 17 32 1 0 0 0 0 13 24 1 6 0 0 0 32 31 1 0 0 0 0 31 28 1 0 0 0 0 14 25 1 1 0 0 0 28 27 1 0 0 0 0 1 20 1 0 0 0 0 28 30 1 0 0 0 0 20 4 1 0 0 0 0 32 33 1 0 0 0 0 3 4 1 0 0 0 0 32 34 2 0 0 0 0 3 2 1 0 0 0 0 28 29 2 0 0 0 0 13 12 1 0 0 0 0 27 16 1 0 0 0 0 15 16 1 0 0 0 0 1 17 1 4 0 0 0 12 26 1 1 0 0 0 2 18 1 1 0 0 0 15 26 1 6 0 0 0 3 19 1 1 0 0 0 15 14 1 0 0 0 0 3 5 1 6 0 0 0 6 7 1 0 0 0 0 5 21 1 0 0 0 0 S SKP 7 ID BMMCPYURS501 NAME UDP-D-apiose FORMULA C14H22N2O16P2 EXACTMASS 536.0444 AVERAGEMASS 536.2758 SMILES OC[C@](O)(C3)[C@@H](O)C(O3)OP(O)(=O)OP(O)(=O)OC[C@@H](O1)[C@@H](O)[C@H](O)[C@H]1N(C=2)C(=O)NC(=O)C2 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01623 M END
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