-OEChem-07191013262D 11 11 0 0 0 0 0 0 0999 V2000 28.3319 -15.7514 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 29.7714 -15.7397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.0154 -15.7338 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.3204 -14.0779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 30.7018 -17.1207 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 28.3319 -17.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.5080 -17.8169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1383 -17.8169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.5080 -19.1861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1383 -19.1861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.3319 -19.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 6 1 0 0 0 0 5 7 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 9 1 0 0 0 0 8 10 2 0 0 0 0 9 11 2 0 0 0 0 10 11 1 0 0 0 0 M END > 0 > 0 > 8569 > 5 > KEGG > C06333 > CAS: 88-21-1 ChEBI: 1015 3DMET: B00940 NIKKAJI: J4.290K Is a reactant or product of enzyme EC 1.14.12.14 > 2-Aminobenzenesulfonate 2-Aminobenzenesulfonic acid 88-21-1 C06333 Orthanilic acid o-Aminobenzenesulfonic acid > 88-21-1 > C06333 > http://www.genome.jp/kegg/ > http://www.genome.jp/dbget-bin/www_bget?cpd+C06333 > 6926 1 > 1 3 $$$$