Mrv1652306031609342D 85 84 0 0 0 0 999 V2000 7.6646 8.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2115 7.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9433 -8.9806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2080 -9.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5494 -7.5805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6365 -11.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5810 7.6275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4589 7.1447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2500 7.1447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3753 6.3240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1664 6.3240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6227 5.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8354 5.8412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5390 5.1653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7517 5.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7864 4.8273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4207 4.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7028 4.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3371 3.7169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9502 3.6686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0061 3.2341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8666 2.8478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9225 2.4133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1140 2.5099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5914 1.9305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0304 1.6891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5078 1.1098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2778 1.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1768 0.6270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1941 0.5304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9294 0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4415 0.1925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5984 0.4821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3579 -0.6283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2847 -7.1460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2011 -7.9668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7726 -6.3735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8562 -5.5528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.3090 -8.6910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.8073 -6.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1001 -1.6422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6855 -2.9457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0269 -8.1599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2916 -8.5944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4658 -8.4013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7202 -10.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7691 -2.1249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0373 -6.8081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5564 -9.0289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7236 -7.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4485 -8.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5147 -0.3386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6053 -0.9662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9710 -7.7254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8874 -8.5461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1209 -5.9873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3579 -7.6771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6227 -8.1116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7132 -8.7392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4519 -5.5045 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.4415 -6.8563 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7795 -7.8219 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 21.0442 -8.2564 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 24.4728 -9.8497 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.7063 -7.2909 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 25.9780 -9.1738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.5599 -6.2287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.0512 -9.7048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.3926 -7.8702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3649 -9.1255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7621 -0.6766 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9363 -0.4834 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.3021 -7.2426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8735 -5.6494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6053 -8.0150 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8701 -8.4496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.6296 -9.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4501 -4.1656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0916 -4.3329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1837 -0.8214 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1872 -5.0700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3544 -3.4285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.1348 -8.8841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5217 -1.7870 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2708 -4.2492 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 7 1 1 0 0 0 0 8 2 1 0 0 0 0 9 7 1 0 0 0 0 10 8 1 0 0 0 0 11 9 1 0 0 0 0 12 10 1 0 0 0 0 13 11 1 0 0 0 0 14 12 1 0 0 0 0 15 13 1 0 0 0 0 16 14 1 0 0 0 0 17 15 1 0 0 0 0 18 16 1 0 0 0 0 19 17 1 0 0 0 0 20 18 1 0 0 0 0 21 19 1 0 0 0 0 22 20 1 0 0 0 0 23 21 1 0 0 0 0 24 22 1 0 0 0 0 25 23 1 0 0 0 0 26 24 1 0 0 0 0 27 25 1 0 0 0 0 28 26 1 0 0 0 0 29 27 1 0 0 0 0 30 28 1 0 0 0 0 31 29 1 0 0 0 0 32 30 1 0 0 0 0 33 31 1 0 0 0 0 34 32 1 0 0 0 0 36 35 1 0 0 0 0 38 37 1 0 0 0 0 43 3 1 0 0 0 0 44 4 1 0 0 0 0 45 5 1 0 0 0 0 46 6 1 0 0 0 0 47 41 1 0 0 0 0 47 42 1 0 0 0 0 48 35 1 0 0 0 0 49 39 1 0 0 0 0 50 40 1 0 0 0 0 51 36 1 0 0 0 0 52 33 1 0 0 0 0 53 34 1 0 0 0 0 54 50 1 0 0 0 0 55 49 1 0 0 0 0 55 54 1 0 0 0 0 56 48 1 0 0 0 0 57 43 1 0 0 0 0 58 44 1 0 0 0 0 59 45 1 0 0 0 0 60 56 2 0 0 0 0 61 37 1 4 0 0 0 61 57 2 0 0 0 0 62 43 1 4 0 0 0 62 51 2 0 0 0 0 63 44 1 4 0 0 0 63 59 2 0 0 0 0 64 46 2 0 0 0 0 64 49 1 4 0 0 0 65 48 1 4 0 0 0 65 58 2 0 0 0 0 66 39 2 0 0 0 0 67 40 1 0 0 0 0 68 46 1 0 0 0 0 69 50 1 0 0 0 0 70 51 1 0 0 0 0 71 52 2 0 0 0 0 72 53 2 0 0 0 0 73 54 1 0 0 0 0 74 56 1 0 0 0 0 75 57 1 0 0 0 0 76 58 1 0 0 0 0 77 59 1 0 0 0 0 80 41 1 0 0 0 0 80 52 1 0 0 0 0 81 38 1 0 0 0 0 82 42 1 0 0 0 0 83 45 1 0 0 0 0 83 55 1 0 0 0 0 84 47 1 0 0 0 0 84 53 1 0 0 0 0 85 78 1 0 0 0 0 85 79 2 0 0 0 0 85 81 1 0 0 0 0 85 82 1 0 0 0 0 M END > CHEM045670 > chemdb > CCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCCN=C(O)C(C)N=C(O)CCC(N=C(O)C(C)N=C(O)C(C)OC(C(O)C(O)CO)C(C=O)N=C(C)O)C(O)=N)OC(=O)CCCCCCCCCCCCCCC > InChI=1S/C59H109N6O19P/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-52(71)80-41-47(84-53(72)34-32-30-28-26-24-22-20-18-16-14-12-10-8-2)42-82-85(78,79)81-38-37-61-57(75)43(3)62-51(70)36-35-48(56(60)74)65-58(76)44(4)63-59(77)45(5)83-55(54(73)50(69)40-67)49(39-66)64-46(6)68/h39,43-45,47-50,54-55,67,69,73H,7-38,40-42H2,1-6H3,(H2,60,74)(H,61,75)(H,62,70)(H,63,77)(H,64,68)(H,65,76)(H,78,79) > ZVLWUMPAHCEZAW-UHFFFAOYSA-N > C59H109N6O19P > 1237.518 > 1236.748512312 > 21 > 194 > 139.31083891432442 > 0 > 11 > 0 > 0 > N'-(1-{[2-({[2,3-bis(hexadecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)ethyl]-C-hydroxycarbonimidoyl}ethyl)-2-[(1-hydroxy-2-{[1-hydroxy-2-({4,5,6-trihydroxy-2-[(1-hydroxyethylidene)amino]-1-oxohexan-3-yl}oxy)propylidene]amino}propylidene)amino]pentanediimidic acid > 4.92 > 7.833112834879617 > -5.63 > 0 > 0 > -1 > 1.8760882637450722 > -2.825009767198254 > 12.668768541560642 > 402.3800000000001 > 329.63049999999976 > 58 > 0 > 2.88e-03 g/l > N'-{1-[(2-{[2,3-bis(hexadecanoyloxy)propoxy(hydroxy)phosphoryl]oxy}ethyl)-C-hydroxycarbonimidoyl]ethyl}-2-[(1-hydroxy-2-{[1-hydroxy-2-({4,5,6-trihydroxy-2-[(1-hydroxyethylidene)amino]-1-oxohexan-3-yl}oxy)propylidene]amino}propylidene)amino]pentanediimidic acid > 0 > mifamurtide > 83461-56-7 $$$$