565 Mrv0541 02231214462D 87 92 0 0 1 0 999 V2000 1.1575 10.9118 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.4194 18.8370 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2289 12.4942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.7064 4.1357 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6924 13.3392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.7064 5.8255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8919 8.1405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6045 5.9971 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6544 7.4260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6045 4.5680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5589 12.0445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.2230 0.8555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1299 11.2195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.6519 1.6805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1575 11.7368 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 13.4194 19.6620 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.9825 10.9118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3325 10.9118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2444 18.8370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5944 18.8370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4168 9.5695 0.0000 N 0 3 2 0 0 0 0 0 0 0 0 0 18.0795 4.5680 0.0000 N 0 3 2 0 0 0 0 0 0 0 0 0 8.7024 9.9820 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 18.7940 4.1555 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1313 9.9820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0795 5.3931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8293 8.8550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2545 4.5680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7024 10.8070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5085 4.5680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1313 10.8070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7940 5.8056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0043 8.8550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6670 3.8536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9878 9.5695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7940 3.3305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4168 11.2195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5085 5.3931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6544 8.8550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8420 5.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9516 11.2252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2460 4.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2734 9.9820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5085 2.9180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4300 12.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2460 5.8342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9449 12.0845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9935 4.5509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6892 12.5142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9935 5.4103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0669 8.1405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0170 5.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2734 10.8070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5085 2.0930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5589 9.5695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2230 3.3305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5589 11.2195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2230 1.6805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8444 9.9820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9375 2.9180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8444 10.8070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9375 2.0930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3044 7.4260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7795 5.9971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1294 7.4260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3669 6.7115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2257 13.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4225 4.5454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5419 6.7115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4084 13.7489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7033 6.6506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8444 12.4570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5085 0.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4154 10.8070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6519 0.8555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1575 10.0868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4194 18.0120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 9.6742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1340 17.5995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 9.6742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7049 17.5995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 8.8492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1340 16.7744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 8.8492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7049 16.7744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1575 8.4367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4194 16.3619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 17 2 0 0 0 0 1 18 2 0 0 0 0 1 76 1 0 0 0 0 2 16 1 0 0 0 0 2 19 2 0 0 0 0 2 20 2 0 0 0 0 2 77 1 0 0 0 0 3 47 1 0 0 0 0 3 67 1 0 0 0 0 4 48 1 0 0 0 0 4 68 1 0 0 0 0 5 49 1 0 0 0 0 5 70 1 0 0 0 0 6 50 1 0 0 0 0 6 71 1 0 0 0 0 7 51 1 0 0 0 0 7 63 1 0 0 0 0 8 52 1 0 0 0 0 8 64 1 0 0 0 0 9 51 2 0 0 0 0 10 52 2 0 0 0 0 11 57 1 0 0 0 0 11 72 1 0 0 0 0 12 58 1 0 0 0 0 12 73 1 0 0 0 0 13 61 1 0 0 0 0 13 74 1 0 0 0 0 14 62 1 0 0 0 0 14 75 1 0 0 0 0 21 23 1 0 0 0 0 21 25 1 0 0 0 0 21 27 1 0 0 0 0 21 33 1 1 0 0 0 22 24 1 0 0 0 0 22 26 1 0 0 0 0 22 28 1 0 0 0 0 22 34 1 6 0 0 0 23 29 1 0 0 0 0 23 35 1 6 0 0 0 24 30 1 0 0 0 0 24 36 1 1 0 0 0 25 31 1 0 0 0 0 26 32 1 0 0 0 0 27 39 1 0 0 0 0 28 40 1 0 0 0 0 29 37 1 0 0 0 0 29 41 2 0 0 0 0 30 38 1 0 0 0 0 30 42 2 0 0 0 0 31 37 1 0 0 0 0 32 38 1 0 0 0 0 35 43 1 0 0 0 0 36 44 1 0 0 0 0 37 45 2 0 0 0 0 38 46 2 0 0 0 0 39 51 1 0 0 0 0 40 52 1 0 0 0 0 41 47 1 0 0 0 0 42 48 1 0 0 0 0 43 53 2 0 0 0 0 43 55 1 0 0 0 0 44 54 2 0 0 0 0 44 56 1 0 0 0 0 45 49 1 0 0 0 0 46 50 1 0 0 0 0 47 49 2 0 0 0 0 48 50 2 0 0 0 0 53 57 1 0 0 0 0 54 58 1 0 0 0 0 55 59 2 0 0 0 0 56 60 2 0 0 0 0 57 61 2 0 0 0 0 58 62 2 0 0 0 0 59 61 1 0 0 0 0 60 62 1 0 0 0 0 63 65 1 0 0 0 0 64 66 1 0 0 0 0 65 69 1 0 0 0 0 66 69 1 0 0 0 0 76 78 2 0 0 0 0 76 80 1 0 0 0 0 77 79 2 0 0 0 0 77 81 1 0 0 0 0 78 82 1 0 0 0 0 79 83 1 0 0 0 0 80 84 2 0 0 0 0 81 85 2 0 0 0 0 82 86 2 0 0 0 0 83 87 2 0 0 0 0 84 86 1 0 0 0 0 85 87 1 0 0 0 0 M CHG 4 15 -1 16 -1 21 1 22 1 M END > DB00565 > drugbank > [O-]S(=O)(=O)C1=CC=CC=C1.[O-]S(=O)(=O)C1=CC=CC=C1.COC1=C(OC)C=C(C[C@@H]2C3=CC(OC)=C(OC)C=C3CC[N@+]2(C)CCC(=O)OCCCCCOC(=O)CC[N@@+]2(C)CCC3=CC(OC)=C(OC)C=C3[C@H]2CC2=CC(OC)=C(OC)C=C2)C=C1 > InChI=1S/C53H72N2O12.2C6H6O3S/c1-54(22-18-38-32-48(62-7)50(64-9)34-40(38)42(54)28-36-14-16-44(58-3)46(30-36)60-5)24-20-52(56)66-26-12-11-13-27-67-53(57)21-25-55(2)23-19-39-33-49(63-8)51(65-10)35-41(39)43(55)29-37-15-17-45(59-4)47(31-37)61-6;2*7-10(8,9)6-4-2-1-3-5-6/h14-17,30-35,42-43H,11-13,18-29H2,1-10H3;2*1-5H,(H,7,8,9)/q+2;;/p-2/t42-,43-,54-,55-;;/m1../s1 > InChIKey=XXZSQOVSEBAPGS-DONVQRBFSA-L > 10 > 105.54862065626298 > 0 > 0 > 1242.50040521 > 0 > C65H82N2O18S2 > 0 > (1R,2R)-1-[(3,4-dimethoxyphenyl)methyl]-2-(3-{[5-({3-[(1R,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]propanoyl}oxy)pentyl]oxy}-3-oxopropyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium dibenzenesulfonate > 3.34 > -0.9590320619434906 > -7.47 > 1243.479 > 1 > 8 > 2 > 19.618566918135095 > 19.016506926807132 > -4.114322707937125 > 126.44000000000003 > 280.6771999999999 > 28 > 0 > 4.17e-05 g/l > (1R,2R)-1-[(3,4-dimethoxyphenyl)methyl]-2-(3-{[5-({3-[(1R,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoyl}oxy)pentyl]oxy}-3-oxopropyl)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium dibenzenesulfonate > 0 > DB00565 > approved > Cisatracurium Besylate > Besilate de cisatracurium; Besilato de cisatracurio; Cisatracurii besilas; Cisatracurium-Kation > Nimbex; Nimbex Forte; Nimbium $$$$