1111 Mrv0541 02231215152D 107107 0 0 1 0 999 V2000 9.8947 10.0289 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 21.4858 6.1320 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 19.5075 1.3550 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1341 7.9909 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2839 6.1057 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 16.5334 9.5561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6297 7.3115 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4621 9.5561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3657 7.3115 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4201 4.2474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0547 4.8580 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5345 1.7191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0377 2.3091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0275 2.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9950 2.7273 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2225 5.7680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2044 2.9729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3723 3.8829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3740 10.6688 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.2547 9.5082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5347 10.5495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.2935 5.9642 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 21.3179 5.3243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.6536 6.9398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9362 0.6501 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 18.8026 0.9263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.2124 1.7837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7714 8.7319 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.8752 8.3537 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3932 7.6281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9211 6.8468 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.5429 5.7430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0249 6.4686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9096 8.3707 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5853 9.0220 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.0202 6.2274 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5228 7.7678 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1522 6.2838 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.2118 3.9529 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.9978 2.9912 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4084 4.9707 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7837 3.9529 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2299 9.5198 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.1287 5.6842 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3020 4.3986 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5582 3.0855 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.2540 2.0411 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3200 7.1936 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4698 5.3085 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.4103 9.0220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4728 7.7678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5226 9.8393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1468 8.2436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8710 10.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0718 9.0651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2047 8.7994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0859 8.3707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8523 7.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9639 5.4043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7908 8.7994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9754 6.2274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5652 9.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7716 5.2365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9833 11.1626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1069 10.0339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7458 9.5409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3227 9.4110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0316 5.4043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5719 3.4322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1432 7.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6876 4.6270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8688 5.6554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7079 1.2004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7506 8.8797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1683 1.8851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3079 4.6270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3210 5.8521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0005 2.7273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9913 1.8288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1804 3.1035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6919 5.5991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5059 6.3963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4517 2.5135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8151 3.1035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1250 4.3423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8848 1.2567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0185 3.7702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9578 2.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4237 3.4322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8253 2.7461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2747 2.4572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0708 0.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5854 5.0270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6829 6.4527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4879 3.6014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6557 4.5112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8416 3.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7351 3.1418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4245 0.5720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4154 9.3889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8326 4.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1585 2.1047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6780 6.2999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3109 3.5450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0788 2.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4970 7.2499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6467 5.3648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 20 2 0 0 0 0 1 21 2 0 0 0 0 1100 1 0 0 0 0 2 22 1 0 0 0 0 2 23 2 0 0 0 0 2 24 2 0 0 0 0 2103 1 0 0 0 0 3 25 1 0 0 0 0 3 26 2 0 0 0 0 3 27 2 0 0 0 0 3105 1 0 0 0 0 4 28 1 0 0 0 0 4 29 2 0 0 0 0 4 30 2 0 0 0 0 4106 1 0 0 0 0 5 31 1 0 0 0 0 5 32 2 0 0 0 0 5 33 2 0 0 0 0 5107 1 0 0 0 0 6 56 2 0 0 0 0 7 58 2 0 0 0 0 8 60 2 0 0 0 0 9 70 2 0 0 0 0 10 71 2 0 0 0 0 11 81 2 0 0 0 0 12 88 1 0 0 0 0 13 84 2 0 0 0 0 14 95 1 0 0 0 0 15 89 2 0 0 0 0 16 93 2 0 0 0 0 17 97 2 0 0 0 0 18 98 2 0 0 0 0 34 51 1 0 0 0 0 34 56 1 0 0 0 0 35 50 1 0 0 0 0 35 60 1 0 0 0 0 36 58 1 0 0 0 0 36 59 1 0 0 0 0 37 57 1 0 0 0 0 37 70 1 0 0 0 0 38 61 1 0 0 0 0 38 81 1 0 0 0 0 39 69 1 0 0 0 0 39 71 1 0 0 0 0 40 80 1 0 0 0 0 40 84 1 0 0 0 0 41 72 1 0 0 0 0 41 93 1 0 0 0 0 42 76 1 0 0 0 0 42 89 1 0 0 0 0 43 74 1 0 0 0 0 43100 1 0 0 0 0 44 77 1 0 0 0 0 44103 1 0 0 0 0 45 85 1 0 0 0 0 45 97 1 0 0 0 0 46 87 1 0 0 0 0 46 98 1 0 0 0 0 47 90 1 0 0 0 0 47105 1 0 0 0 0 48 94 1 0 0 0 0 48106 1 0 0 0 0 49101 1 0 0 0 0 49107 1 0 0 0 0 50 52 1 0 0 0 0 50 56 1 0 0 0 0 51 53 1 0 0 0 0 51 58 1 0 0 0 0 52 54 1 0 0 0 0 53 55 1 0 0 0 0 54 64 1 0 0 0 0 54 65 1 0 0 0 0 55 66 1 0 0 0 0 55 67 1 0 0 0 0 57 60 1 0 0 0 0 57 62 1 0 0 0 0 59 63 1 0 0 0 0 59 71 1 0 0 0 0 61 68 1 0 0 0 0 61 70 1 0 0 0 0 62 74 1 0 0 0 0 63 77 1 0 0 0 0 68 76 1 0 0 0 0 69 78 1 0 0 0 0 69 84 1 0 0 0 0 72 81 1 0 0 0 0 72 82 1 0 0 0 0 73 75 1 0 0 0 0 73 86 1 0 0 0 0 73 92 1 0 0 0 0 75 79 1 0 0 0 0 78 90 1 0 0 0 0 79 83 1 0 0 0 0 80 88 1 0 0 0 0 80 89 1 0 0 0 0 82 94 1 0 0 0 0 83 91 1 0 0 0 0 85 93 1 0 0 0 0 85 95 1 0 0 0 0 86 99 1 0 0 0 0 87 96 1 0 0 0 0 87 97 1 0 0 0 0 88102 1 0 0 0 0 91 98 1 0 0 0 0 95104 1 0 0 0 0 96101 1 0 0 0 0 M CHG 5 19 -1 22 -1 25 -1 28 -1 31 -1 M END > DB01111 > drugbank > CCC(C)CCCCC(=O)NC(CCNCS([O-])(=O)=O)C(=O)NC(C(C)O)C(=O)NC(CCNCS([O-])(=O)=O)C(=O)NC1CCNC(=O)C(NC(=O)C(CCNCS([O-])(=O)=O)NC(=O)C(CCNCS([O-])(=O)=O)NC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)C(CCNCS([O-])(=O)=O)NC1=O)C(C)O > InChI=1S/C58H110N16O28S5/c1-9-35(6)12-10-11-13-46(77)65-38(14-20-59-28-103(88,89)90)53(82)74-48(37(8)76)58(87)70-41(17-23-62-31-106(97,98)99)50(79)68-43-19-25-64-57(86)47(36(7)75)73-54(83)42(18-24-63-32-107(100,101)102)67-49(78)39(15-21-60-29-104(91,92)93)69-55(84)44(26-33(2)3)72-56(85)45(27-34(4)5)71-52(81)40(66-51(43)80)16-22-61-30-105(94,95)96/h33-45,47-48,59-63,75-76H,9-32H2,1-8H3,(H,64,86)(H,65,77)(H,66,80)(H,67,78)(H,68,79)(H,69,84)(H,70,87)(H,71,81)(H,72,85)(H,73,83)(H,74,82)(H,88,89,90)(H,91,92,93)(H,94,95,96)(H,97,98,99)(H,100,101,102)/p-5 > BSSIRFLGSWHWDE-UHFFFAOYSA-I > C58H105N16O28S5 > 1634.87 > 1633.588775306 > 33 > 212 > -3.0748712670700713 > 161.89600803598023 > 0 > 18 > -5 > 0 > [(3-{3-hydroxy-2-[2-(6-methyloctanamido)-4-[(sulfonatomethyl)amino]butanamido]butanamido}-3-{[3-(1-hydroxyethyl)-12,15-bis(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-6,9,18-tris({2-[(sulfonatomethyl)amino]ethyl})-1,4,7,10,13,16,19-heptaazacyclotricosan-21-yl]carbamoyl}propyl)amino]methanesulfonate > -1.23 > -16.56502576406156 > -2.62 > 0 > -2 > 1 > -3 > -3.846980007506901 > -4.324215007324904 > 7.063904524870402 > 706.7099999999995 > 370.1856 > 44 > 0 > 4.17e+00 g/l > biotin > 0 > DB01111 > APRD00885 > approved; vet_approved > Colistimethate > Colistin methanesulfonic acid; Colistin sulfomethate; Colistinmethanesulfonic acid > Colistimethate; Colistimethate Sodium; Colistimethate for Injection; Colistimethate for Injection U.S.P.; Colistimethate for Injection USP; Colobreathe; Coly-Mycin M > Colistimethate sodium $$$$