Mrv1652309022221162D 100101 0 0 0 0 999 V2000 -10.3892 -6.1196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7171 -5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5366 -5.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8644 -4.5108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6840 -4.4162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0118 -3.6591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5201 -2.9967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7005 -3.0913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2088 -2.4288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3892 -2.5235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8975 -1.8610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0780 -1.9557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5862 -1.2932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7667 -1.3879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2749 -0.7254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4554 -0.8201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1276 -1.5771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9636 -0.1576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1441 -0.2523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8163 -1.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9967 -1.1040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6689 -1.8610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8493 -1.9557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5215 -2.7127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -2.8074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3741 -3.5645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5546 -3.6591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2268 -4.4162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5928 -4.5108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9206 -5.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7402 -5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2319 -4.7001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -6.1196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6524 0.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8328 0.3155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5050 -0.4415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3411 0.9780 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5215 0.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0298 1.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3576 2.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8659 2.9653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1937 3.7224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0133 3.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3411 4.5741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1606 4.6687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6524 4.0063 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -5.3148 4.4980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9899 3.5145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1441 3.3438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8493 5.2365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1772 5.9936 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9967 6.0882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3245 6.8453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4885 5.4258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3080 5.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6358 6.2775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7997 4.8580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6193 4.9526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1110 4.2902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9306 4.3848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4223 3.7224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2419 3.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7336 3.1546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5532 3.2492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0449 2.5868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8644 2.6814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3562 2.0190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1757 2.1136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6675 1.4511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5035 2.8707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0298 5.1419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5381 5.8043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8659 6.5614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6854 6.6560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3741 7.2238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 7.9809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5215 8.0755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2102 8.6433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5381 9.4004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0463 10.0628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3741 10.8199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8824 11.4824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2102 12.2394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7185 12.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0463 13.6589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5546 14.3214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8824 15.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3907 15.7409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7185 16.4980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2268 17.1604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 4.3848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8824 4.2902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2102 1.4511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8824 0.6941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0629 0.5994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -0.1576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3741 0.0316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0463 -0.7254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1937 0.1263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6854 -0.5362 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 1 0 0 0 0 6 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 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 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 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 19 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 37 38 1 4 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 2 0 0 0 0 46 48 1 0 0 0 0 46 49 1 0 0 0 0 44 50 1 0 0 0 0 51 50 1 4 0 0 0 51 52 2 0 0 0 0 52 53 1 0 0 0 0 52 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 57 58 1 0 0 0 0 58 59 1 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 65 1 0 0 0 0 65 66 1 0 0 0 0 66 67 1 0 0 0 0 67 68 1 0 0 0 0 68 69 1 0 0 0 0 68 70 1 0 0 0 0 50 71 1 0 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 73 74 2 0 0 0 0 73 75 1 0 0 0 0 75 76 1 0 0 0 0 76 77 1 0 0 0 0 76 78 1 0 0 0 0 78 79 1 0 0 0 0 79 80 1 0 0 0 0 80 81 1 0 0 0 0 81 82 1 0 0 0 0 82 83 1 0 0 0 0 83 84 1 0 0 0 0 84 85 1 0 0 0 0 85 86 1 0 0 0 0 86 87 1 0 0 0 0 87 88 1 0 0 0 0 88 89 1 0 0 0 0 89 90 1 0 0 0 0 71 91 1 0 0 0 0 42 91 1 0 0 0 0 91 92 1 0 0 0 0 39 93 1 0 0 0 0 93 94 1 0 0 0 0 94 95 1 0 0 0 0 95 96 1 0 0 0 0 94 97 1 0 0 0 0 97 98 1 0 0 0 0 97 99 1 0 0 0 0 38 99 1 0 0 0 0 99100 1 0 0 0 0 M END > NP0161164 > NP-MRD > CCCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCCC(C)C)CC(O)=NC1C(OCC2OC(OP(O)(O)=O)C(N=C(O)CC(O)CCCCCCCCCCCC(C)C)C(OC(=O)CC(O)CCCCCCCCCCCCC)C2O)OC(CO)C(O)C1O > InChI=1S/C78H149N2O19P/c1-7-9-11-13-15-17-19-20-22-30-36-42-48-54-69(86)95-64(53-47-41-35-29-24-26-32-38-44-50-61(5)6)57-68(85)79-71-75(90)73(88)65(58-81)96-77(71)94-59-66-74(89)76(98-70(87)56-63(83)52-46-40-34-27-21-18-16-14-12-10-8-2)72(78(97-66)99-100(91,92)93)80-67(84)55-62(82)51-45-39-33-28-23-25-31-37-43-49-60(3)4/h60-66,71-78,81-83,88-90H,7-59H2,1-6H3,(H,79,85)(H,80,84)(H2,91,92,93) > PLELIMGHEDFXFZ-UHFFFAOYSA-N > C78H149N2O19P > 1450.019 > 1449.049217584 > 18 > 249 > 176.20928506142513 > 0 > 10 > 0 > 0 > N-[2-({5-[(1,3-dihydroxy-15-methylhexadecylidene)amino]-3-hydroxy-4-[(3-hydroxyhexadecanoyl)oxy]-6-(phosphonooxy)oxan-2-yl}methoxy)-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]-3-(hexadecanoyloxy)-15-methylhexadecanimidic acid > 7.01 > 19.919766751999997 > -6.00 > 0 > 2 > -2 > 4.77770024930448 > 1.0332535164181187 > -3.6272704907209548 > 333.61000000000007 > 392.1618999999999 > 68 > 0 > 1.46e-03 g/l > N-[2-({5-[(1,3-dihydroxy-15-methylhexadecylidene)amino]-3-hydroxy-4-[(3-hydroxyhexadecanoyl)oxy]-6-(phosphonooxy)oxan-2-yl}methoxy)-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]-3-(hexadecanoyloxy)-15-methylhexadecanimidic acid > 0 > NP0161164 > n-[2-({5-[(1,3-dihydroxy-15-methylhexadecylidene)amino]-3-hydroxy-4-[(3-hydroxyhexadecanoyl)oxy]-6-(phosphonooxy)oxan-2-yl}methoxy)-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]-3-(hexadecanoyloxy)-15-methylhexadecanimidic acid $$$$