CDK 0306170844 35 36 0 0 0 0 0 0 0 0999 V2000 12.7579 -9.9135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7579 -10.7501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0468 -11.1684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3357 -10.7501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3357 -9.9135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0468 -9.4952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6246 -11.1684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8717 -10.7501 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1606 -11.1684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4495 -10.7501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4495 -9.9135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1606 -9.4952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8717 -9.9135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6966 -9.4952 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9436 -9.9135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2325 -9.4952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9436 -10.7501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5214 -9.9135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7685 -9.4952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7685 -8.6168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5214 -8.1985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2325 -8.6168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9436 -8.1985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0574 -8.1985 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0574 -9.9135 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.9436 -7.3619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7317 -9.8717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0206 -9.4534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4846 -9.4534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3095 -9.8717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4846 -8.6168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1957 -9.8717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3095 -10.7501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5565 -9.4534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0206 -8.6168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15 17 2 0 0 0 0 7 8 1 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 16 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 16 1 0 0 0 0 5 6 2 0 0 0 0 22 23 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 20 24 1 0 0 0 0 10 11 1 0 0 0 0 19 25 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 8 1 0 0 0 0 6 1 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 4 7 1 0 0 0 0 15 16 1 0 0 0 0 23 26 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 29 31 2 0 0 0 0 29 32 1 0 0 0 0 30 33 2 0 0 0 0 30 34 1 0 0 0 0 28 35 1 0 0 0 0 M CHG 1 8 1 M CHG 1 34 -1 M END > CHEBI:31408 > Clebopride malate > 2 > Clebopride malate > C24H30ClN3O7; C20H25ClN3O2.C4H5O5 > 507.965 > 507.17723 > 0 > C1=CC=C(C=C1)C[NH+]2CCC(CC2)NC(=O)C3=CC(=C(C=C3OC)N)Cl.C(C(C(=O)[O-])O)C(=O)O > InChI=1S/C20H24ClN3O2.C4H6O5/c1-26-19-12-18(22)17(21)11-16(19)20(25)23-15-7-9-24(10-8-15)13-14-5-3-2-4-6-14;5-2(4(8)9)1-3(6)7/h2-6,11-12,15H,7-10,13,22H2,1H3,(H,23,25);2,5H,1H2,(H,6,7)(H,8,9) > NYNKCGWJPNZJMI-UHFFFAOYSA-N > 57645-91-7 > D01742 $$$$