Mol:BMMCPYURe006
From Metabolomics.JP
(Difference between revisions)
Line 1: | Line 1: | ||
− | + | ||
− | + | ||
− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 23 24 0 0 1 0 0 0 0 0999 V2000 | + | 23 24 0 0 1 0 0 0 0 0999 V2000 |
− | 3.7321 -1.4397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -1.4397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8660 -1.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -1.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8660 -2.9397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -2.9397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 -3.4397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -3.4397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.5981 -2.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -2.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.5981 -1.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -1.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0000 -1.4397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -1.4397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 -4.4397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -4.4397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.4641 -3.4397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 -3.4397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.4641 -1.4397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 -1.4397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.4641 -0.4397 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 5.4641 -0.4397 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
− | 6.2731 0.1481 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 6.2731 0.1481 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
− | 5.9641 1.0991 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 5.9641 1.0991 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
− | 4.9641 1.0991 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 4.9641 1.0991 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
− | 4.3763 1.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3763 1.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 7.2242 -0.1610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.2242 -0.1610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 6.5519 1.9081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.5519 1.9081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.6551 0.1481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6551 0.1481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.7831 2.8217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.7831 2.8217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.1953 3.6307 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1953 3.6307 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.3863 3.0429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3863 3.0429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.0043 4.2185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.0043 4.2185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.6075 4.4397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6075 4.4397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5 4 1 0 0 0 0 | + | 5 4 1 0 0 0 0 |
− | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
− | 6 1 1 0 0 0 0 | + | 6 1 1 0 0 0 0 |
− | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
− | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
− | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
− | 4 8 2 0 0 0 0 | + | 4 8 2 0 0 0 0 |
− | 2 7 2 0 0 0 0 | + | 2 7 2 0 0 0 0 |
− | 5 9 1 0 0 0 0 | + | 5 9 1 0 0 0 0 |
− | 12 11 1 0 0 0 0 | + | 12 11 1 0 0 0 0 |
− | 11 18 1 6 0 0 0 | + | 11 18 1 6 0 0 0 |
− | 14 18 1 6 0 0 0 | + | 14 18 1 6 0 0 0 |
− | 14 13 1 0 0 0 0 | + | 14 13 1 0 0 0 0 |
− | 13 12 1 0 0 0 0 | + | 13 12 1 0 0 0 0 |
− | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
− | 11 10 1 0 0 0 0 | + | 11 10 1 0 0 0 0 |
− | 13 17 1 1 0 0 0 | + | 13 17 1 1 0 0 0 |
− | 12 16 1 1 0 0 0 | + | 12 16 1 1 0 0 0 |
− | 15 19 1 0 0 0 0 | + | 15 19 1 0 0 0 0 |
− | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
− | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
− | 20 23 1 0 0 0 0 | + | 20 23 1 0 0 0 0 |
− | 20 22 2 0 0 0 0 | + | 20 22 2 0 0 0 0 |
− | 6 10 1 0 0 0 0 | + | 6 10 1 0 0 0 0 |
− | S SKP 7 | + | S SKP 7 |
− | ID BMMCPYURe006 | + | ID BMMCPYURe006 |
− | NAME 5-Amino-6-(5'-phospho-ribosylamino)-uracil | + | NAME 5-Amino-6-(5'-phospho-ribosylamino)-uracil |
− | FORMULA C9H15N4O9P | + | FORMULA C9H15N4O9P |
− | EXACTMASS 354.0576 | + | EXACTMASS 354.0576 |
− | AVERAGEMASS 354.2107 | + | AVERAGEMASS 354.2107 |
− | SMILES O=C(N1)NC(N[C@H](O2)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)2)=C(N)C(=O)1 | + | SMILES O=C(N1)NC(N[C@H](O2)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)2)=C(N)C(=O)1 |
− | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01268 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01268 |
M END | M END | ||
− |
Revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 23 24 0 0 1 0 0 0 0 0999 V2000 3.7321 -1.4397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -3.4397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -4.4397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.4397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.4397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4397 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2731 0.1481 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9641 1.0991 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9641 1.0991 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3763 1.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2242 -0.1610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5519 1.9081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6551 0.1481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7831 2.8217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1953 3.6307 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 3.3863 3.0429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0043 4.2185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6075 4.4397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5 4 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 8 2 0 0 0 0 2 7 2 0 0 0 0 5 9 1 0 0 0 0 12 11 1 0 0 0 0 11 18 1 6 0 0 0 14 18 1 6 0 0 0 14 13 1 0 0 0 0 13 12 1 0 0 0 0 14 15 1 0 0 0 0 11 10 1 0 0 0 0 13 17 1 1 0 0 0 12 16 1 1 0 0 0 15 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 20 22 2 0 0 0 0 6 10 1 0 0 0 0 S SKP 7 ID BMMCPYURe006 NAME 5-Amino-6-(5'-phospho-ribosylamino)-uracil FORMULA C9H15N4O9P EXACTMASS 354.0576 AVERAGEMASS 354.2107 SMILES O=C(N1)NC(N[C@H](O2)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)2)=C(N)C(=O)1 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01268 M END