Mrv1652309022221452D 58 60 0 0 0 0 999 V2000 10.1333 -11.1614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4188 -10.7489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4188 -9.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7043 -9.5114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9899 -9.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9899 -10.7489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2754 -9.5114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5609 -9.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8464 -9.5114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1320 -9.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4175 -9.5114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 -9.9239 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 -10.7489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9886 -9.5114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2741 -9.9239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9886 -8.6864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2741 -8.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5596 -8.6864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8451 -8.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1307 -8.6864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5838 -8.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2983 -8.6864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0127 -8.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7272 -8.6864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4417 -8.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1562 -8.6864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8706 -8.2739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1562 -9.5114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2754 -8.6864 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5609 -8.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8464 -8.6864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5609 -7.4489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2284 -6.9640 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9734 -6.1794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4583 -5.5120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1228 -4.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6077 -4.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4282 -4.1771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7637 -4.9308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2788 -5.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6144 -6.3519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1484 -6.1794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8935 -6.9640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1089 -7.2190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1333 -9.5114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1333 -8.6864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8477 -9.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8477 -10.7489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5622 -9.5114 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2767 -9.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9583 -9.4592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7467 -9.7024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0481 -10.4703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6356 -11.1848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8198 -11.3078 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5766 -12.0961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2150 -10.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4471 -11.0480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 29 7 1 4 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 38 39 1 0 0 0 0 39 40 2 0 0 0 0 35 40 1 0 0 0 0 40 41 1 0 0 0 0 34 42 1 0 0 0 0 42 43 1 0 0 0 0 32 43 1 0 0 0 0 43 44 1 0 0 0 0 3 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 47 48 1 0 0 0 0 47 49 2 0 0 0 0 49 50 1 4 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 50 57 1 0 0 0 0 57 58 2 0 0 0 0 M END > NP0161555 > NP-MRD > CCC(OC(=O)C(CCCCN(O)C(=O)\C=C/CCCCCCCCC(O)=O)N=C(O)C1N=C(OC1C)C1=CC=CC=C1O)C(C)C(O)=NC1CCCCN(O)C1=O > InChI=1S/C41H61N5O12/c1-4-33(27(2)37(51)42-30-20-15-18-26-46(56)40(30)53)58-41(54)31(43-38(52)36-28(3)57-39(44-36)29-19-13-14-22-32(29)47)21-16-17-25-45(55)34(48)23-11-9-7-5-6-8-10-12-24-35(49)50/h11,13-14,19,22-23,27-28,30-31,33,36,47,55-56H,4-10,12,15-18,20-21,24-26H2,1-3H3,(H,42,51)(H,43,52)(H,49,50)/b23-11- > BYSSOXZYTLAFLQ-KSEXSDGBSA-N > C41H61N5O12 > 815.962 > 815.431672424 > 13 > 119 > 88.65573133467906 > 0 > 6 > 0 > 0 > (10Z)-11-{hydroxy[6-({1-[(1-hydroxy-2-oxoazepan-3-yl)-C-hydroxycarbonimidoyl]-1-methylbutan-2-yl}oxy)-5-({hydroxy[2-(2-hydroxyphenyl)-5-methyl-4,5-dihydro-1,3-oxazol-4-yl]methylidene}amino)-6-oxohexyl]carbamoyl}undec-10-enoic acid > 3.90 > 6.986754212513882 > -5.18 > 1 > 3 > -1 > 4.751669859194688 > 3.1862458563384783 > 1.4933769436992705 > 251.67999999999995 > 213.4673000000001 > 25 > 0 > 5.39e-03 g/l > (10Z)-11-{hydroxy[6-({1-[(1-hydroxy-2-oxoazepan-3-yl)-C-hydroxycarbonimidoyl]-1-methylbutan-2-yl}oxy)-5-({hydroxy[2-(2-hydroxyphenyl)-5-methyl-4,5-dihydro-1,3-oxazol-4-yl]methylidene}amino)-6-oxohexyl]carbamoyl}undec-10-enoic acid > 0 > NP0161555 > (10z)-11-{hydroxy[6-({1-[(1-hydroxy-2-oxoazepan-3-yl)-c-hydroxycarbonimidoyl]-1-methylbutan-2-yl}oxy)-5-({hydroxy[2-(2-hydroxyphenyl)-5-methyl-4,5-dihydro-1,3-oxazol-4-yl]methylidene}amino)-6-oxohexyl]carbamoyl}undec-10-enoic acid $$$$