439685 -OEChem-04150811092D 16 16 0 1 0 0 0 0 0999 V2000 2.0000 -0.1410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2633 0.5282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7281 -1.1191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -0.4197 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5691 0.1681 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2601 1.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 1.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 0.1681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5201 -0.1410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6661 -0.4443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8665 1.2480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1953 1.7357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3249 1.7357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6536 1.2480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -1.0397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8529 0.3366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 2 9 1 0 0 0 0 2 16 1 0 0 0 0 3 9 2 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 6 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 M END > 1 > 439685 > 1 > 154 > 3 > 2 > 1 > AAADcYBiMAAAAAAAAAAAAAAAAAAAAWAAAAAAAAAAAAAAAAAAAAAAHgAQCAAACCjBgAQACALAAgAIAAGQGAAAAAAAAAAAAIGIAAACABIAgCAEQAAEFgCQAACcFwAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > (2R)-5-oxopyrrolidine-2-carboxylic acid > (2R)-5-oxo-2-pyrrolidinecarboxylic acid > (2R)-5-oxopyrrolidine-2-carboxylic acid > (2R)-5-oxopyrrolidine-2-carboxylic acid > pyroglutamic acid > InChI=1/C5H7NO3/c7-4-2-1-3(6-4)5(8)9/h3H,1-2H2,(H,6,7)(H,8,9)/t3-/m1/s1/f/h6,8H > -3 > 129.042593 > C5H7NO3 > 129.11398 > C1CC(=O)NC1C(=O)O > C1CC(=O)N[C@H]1C(=O)O > 66.4 > 129.042593 > 0 > 9 > 1 > 0 > 0 > 0 > 0 > 1 > 3 > 5301 > 3 > KEGG > C02237 > CAS: 4042-36-8 ChEBI: 16924 Is a reactant or product of enzyme EC 4.2.1.48 > 4042-36-8 5-Oxo-D-proline C02237 D-5-Pyrrolidone-2-carboxylic acid D-Pyroglutamic acid > 4042-36-8 > C02237 > http://www.genome.jp/kegg/kegg2.html > http://www.genome.jp/dbget-bin/www_bget?cpd+C02237 > 439685 1 > 5 9 6 $$$$