Mrv0541 02241205292D 15 15 0 0 0 0 999 V2000 2.8579 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 2.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 1.2375 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 2.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -1.2375 0.0000 As 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -2.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1105 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5395 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 5 10 1 0 0 0 0 10 11 1 0 0 0 0 7 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 2 0 0 0 0 M END > DB13268 > drugbank > CC(=O)NC1=CC(=CC=C1O)[As](O)(O)=O > InChI=1S/C8H10AsNO5/c1-5(11)10-7-4-6(9(13,14)15)2-3-8(7)12/h2-4,12H,1H3,(H,10,11)(H2,13,14,15) > ODFJOVXVLFUVNQ-UHFFFAOYSA-N > C8H10AsNO5 > 275.0903 > 274.977493852 > 5 > 25 > -1.0463502890707617 > 21.4527658433432 > 1 > 4 > 0 > 1 > (3-acetamido-4-hydroxyphenyl)arsonic acid > -0.15 > -0.03050000000000019 > -1.99 > 0 > -1 > 1 > -1 > 8.486623153311998 > 3.5535356921896244 > -4.5106262412415346 > 106.86000000000001 > 48.890299999999996 > 2 > 1 > 2.80e+00 g/l > biotin > 0 > DB13268 > approved; withdrawn > Acetarsol > Acetarsol > Neo Vagex $$$$