Mol:PR100755
From Metabolomics.JP
(Difference between revisions)
| Line 2: | Line 2: | ||
| − | 11 11 0 0 1 0 0 0 0 0999 V2000 | + | 11 11 0 0 1 0 0 0 0 0999 V2000 |
| − | 24.9301 -16.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 24.9301 -16.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 23.7417 -15.4887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 23.7417 -15.4887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 24.9301 -17.4169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 24.9301 -17.4169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 27.0970 -16.1704 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 27.0970 -16.1704 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 22.5476 -16.1704 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 22.5476 -16.1704 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 26.0077 -18.0402 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 26.0077 -18.0402 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 27.0970 -17.4169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 27.0970 -17.4169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 21.3651 -15.4887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 21.3651 -15.4887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 22.5476 -17.5451 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 22.5476 -17.5451 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 20.1709 -16.1704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 20.1709 -16.1704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 21.3651 -14.1082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 21.3651 -14.1082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 | + | 1 2 1 0 0 0 |
| − | 1 3 2 0 0 0 | + | 1 3 2 0 0 0 |
| − | 1 4 1 0 0 0 | + | 1 4 1 0 0 0 |
| − | 2 5 1 0 0 0 | + | 2 5 1 0 0 0 |
| − | 3 6 1 0 0 0 | + | 3 6 1 0 0 0 |
| − | 4 7 2 0 0 0 | + | 4 7 2 0 0 0 |
| − | 5 8 1 0 0 0 | + | 5 8 1 0 0 0 |
| − | 5 9 1 6 0 0 | + | 5 9 1 6 0 0 |
| − | 8 10 1 0 0 0 | + | 8 10 1 0 0 0 |
| − | 8 11 2 0 0 0 | + | 8 11 2 0 0 0 |
| − | 6 7 1 0 0 0 | + | 6 7 1 0 0 0 |
| − | S SKP | + | S SKP 7 |
| − | CAS_RN 71-00-1 | + | CAS_RN 71-00-1 |
| − | NAME L-Histidine | + | NAME L-Histidine |
| + | ID PR100755 | ||
| + | FORMULA C6H9N3O2 | ||
| + | EXACTMASS 155.069476547 | ||
| + | AVERAGEMASS 155.15467999999998 | ||
| + | SMILES OC(=O)[C@@H](N)Cc(c1)ncn1 | ||
M END | M END | ||
Latest revision as of 10:31, 23 December 2009
11 11 0 0 1 0 0 0 0 0999 V2000 24.9301 -16.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7417 -15.4887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9301 -17.4169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.0970 -16.1704 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 22.5476 -16.1704 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 26.0077 -18.0402 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 27.0970 -17.4169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3651 -15.4887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5476 -17.5451 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.1709 -16.1704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.3651 -14.1082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 2 0 0 0 1 4 1 0 0 0 2 5 1 0 0 0 3 6 1 0 0 0 4 7 2 0 0 0 5 8 1 0 0 0 5 9 1 6 0 0 8 10 1 0 0 0 8 11 2 0 0 0 6 7 1 0 0 0 S SKP 7 CAS_RN 71-00-1 NAME L-Histidine ID PR100755 FORMULA C6H9N3O2 EXACTMASS 155.069476547 AVERAGEMASS 155.15467999999998 SMILES OC(=O)[C@@H](N)Cc(c1)ncn1 M END
