Mrv0541 02241203012D 151157 0 0 1 0 999 V2000 7.3219 -14.6536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6074 -14.2411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8930 -14.6536 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6074 -13.4161 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3219 -13.0036 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0364 -13.4161 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7508 -13.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7508 -12.1786 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0364 -11.7661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3219 -12.1786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6074 -11.7661 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6074 -10.9411 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8688 -10.5146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1301 -10.9411 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3461 -10.5146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8930 -12.1786 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9496 -11.4530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6702 -11.0963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2489 -10.9051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6007 -11.9511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0364 -14.2411 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2020 -9.9109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2001 -10.7359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9136 -11.1500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4847 -11.1467 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7711 -10.7326 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.7731 -9.9076 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0595 -9.4935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3441 -9.9043 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.3422 -10.7293 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0557 -11.1435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0538 -11.9685 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.3384 -12.3793 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.3364 -13.2323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0741 -13.6604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7674 -12.3826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6549 -9.6263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1082 -10.0916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4528 -8.6941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4434 -8.9582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4885 -9.4968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9910 -6.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2895 -6.8479 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7727 -7.4909 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.0713 -8.2600 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.8866 -8.3860 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4033 -7.7430 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.1049 -6.9739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2187 -7.8690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1851 -9.1552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9112 -7.3387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5474 -5.4557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2690 -6.5965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5575 -7.3695 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.0324 -8.0057 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.3208 -8.7787 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.1343 -8.9154 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 15.6595 -8.2790 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.3711 -7.5061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4731 -8.4158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4228 -9.6883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7956 -9.4149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4555 -6.4598 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1454 -4.4904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6757 -5.1687 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8535 -5.1010 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3839 -5.7793 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7364 -6.5252 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5586 -6.5928 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0283 -5.9146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2658 -7.1754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5616 -5.7117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5009 -4.3552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7929 -3.7446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4452 -7.0907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9614 -7.7591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1082 -6.3377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7887 -2.8629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3207 -3.5423 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4983 -3.4767 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0304 -4.1561 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3848 -4.9011 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2072 -4.9667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6752 -4.2873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9168 -5.5805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1881 -4.1403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1440 -2.7317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4344 -2.1179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8397 -6.8726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1253 -6.4601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4108 -6.8726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1253 -5.6351 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8397 -5.2226 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5542 -5.6351 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2687 -5.2226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2687 -4.3976 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5542 -3.9851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8397 -4.3976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1253 -3.9851 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1253 -3.1601 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3866 -2.7336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -3.1601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8639 -2.7336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4108 -4.3976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5868 -3.5626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9754 -2.9177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2776 -3.4620 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5542 -6.4601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1909 -8.8226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9021 -8.4043 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 18.6198 -8.8111 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 19.3310 -8.3929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0488 -8.7996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7600 -8.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4777 -8.7881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1890 -8.3698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9067 -8.7765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6178 -8.3582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3356 -8.7650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0468 -8.3468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7645 -8.7534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.4757 -8.3352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1935 -8.7420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.9045 -8.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.6224 -8.7305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6264 -9.6361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8954 -7.5793 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 29.3336 -8.3123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.6152 -7.2160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.8994 -7.6262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.1862 -7.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.4704 -7.6218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.7572 -7.2070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.0414 -7.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.3283 -7.2026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.6125 -7.6128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.8993 -7.1981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1849 -7.1959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.4691 -7.6061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7559 -7.1914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0402 -7.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3270 -7.1869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6113 -7.5971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8981 -7.1824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1823 -7.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4692 -7.1779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7533 -7.5882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0401 -7.1735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3244 -7.5837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6112 -7.1690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6138 -6.3440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 5 4 1 1 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 6 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 1 0 0 0 8 20 1 6 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 6 0 0 0 12 13 1 0 0 0 0 12 15 1 1 0 0 0 13 14 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 25 1 1 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 6 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 37 1 1 0 0 0 29 40 1 6 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 36 1 6 0 0 0 33 34 1 0 0 0 0 33 20 1 1 0 0 0 34 35 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 43 42 1 1 0 0 0 42 52 1 0 0 0 0 43 44 1 0 0 0 0 43 48 1 0 0 0 0 44 45 1 0 0 0 0 44 51 1 1 0 0 0 45 46 1 0 0 0 0 45 40 1 1 0 0 0 46 47 1 0 0 0 0 46 50 1 6 0 0 0 47 48 1 0 0 0 0 47 49 1 1 0 0 0 54 53 1 1 0 0 0 53 63 1 0 0 0 0 54 55 1 0 0 0 0 54 59 1 0 0 0 0 55 56 1 0 0 0 0 55 49 1 6 0 0 0 56 57 1 0 0 0 0 56 62 1 1 0 0 0 57 58 1 0 0 0 0 57 61 1 6 0 0 0 58 59 1 0 0 0 0 58 60 1 1 0 0 0 65 64 1 1 0 0 0 64 74 1 0 0 0 0 65 66 1 0 0 0 0 65 70 1 0 0 0 0 66 67 1 0 0 0 0 66 73 1 1 0 0 0 67 68 1 0 0 0 0 67 72 1 1 0 0 0 68 69 1 0 0 0 0 68 71 1 6 0 0 0 69 70 1 0 0 0 0 69 51 1 1 0 0 0 75 71 1 0 0 0 0 76 75 1 0 0 0 0 77 75 2 0 0 0 0 79 78 1 1 0 0 0 78 88 1 0 0 0 0 79 80 1 0 0 0 0 79 84 1 0 0 0 0 80 81 1 0 0 0 0 80 87 1 1 0 0 0 81 82 1 0 0 0 0 81 86 1 1 0 0 0 82 83 1 0 0 0 0 82 85 1 6 0 0 0 83 84 1 0 0 0 0 83 72 1 1 0 0 0 89 90 1 0 0 0 0 90 91 2 0 0 0 0 90 92 1 0 0 0 0 93 92 1 1 0 0 0 93 94 1 0 0 0 0 93 98 1 0 0 0 0 94 95 1 0 0 0 0 94108 1 6 0 0 0 95 96 1 0 0 0 0 96 97 1 0 0 0 0 96105 1 1 0 0 0 96 86 1 6 0 0 0 97 98 1 0 0 0 0 98 99 1 0 0 0 0 99100 1 0 0 0 0 99104 1 6 0 0 0 100101 1 0 0 0 0 100103 1 1 0 0 0 101102 1 0 0 0 0 105106 2 0 0 0 0 105107 1 0 0 0 0 109 60 1 0 0 0 0 110109 1 0 0 0 0 111110 1 0 0 0 0 112111 1 0 0 0 0 113112 2 0 0 0 0 114113 1 0 0 0 0 115114 1 0 0 0 0 116115 1 0 0 0 0 117116 1 0 0 0 0 118117 1 0 0 0 0 119118 1 0 0 0 0 120119 1 0 0 0 0 121120 1 0 0 0 0 122121 1 0 0 0 0 123122 1 0 0 0 0 124123 1 0 0 0 0 125124 1 0 0 0 0 111126 1 1 0 0 0 110127 1 6 0 0 0 128125 1 0 0 0 0 129130 1 0 0 0 0 130131 1 0 0 0 0 131132 1 0 0 0 0 132133 1 0 0 0 0 133134 1 0 0 0 0 134135 1 0 0 0 0 135136 1 0 0 0 0 136137 1 0 0 0 0 137138 2 0 0 0 0 138139 1 0 0 0 0 139140 1 0 0 0 0 140141 1 0 0 0 0 141142 1 0 0 0 0 142143 1 0 0 0 0 143144 1 0 0 0 0 144145 1 0 0 0 0 145146 1 0 0 0 0 146147 1 0 0 0 0 147148 1 0 0 0 0 148149 1 0 0 0 0 149150 1 0 0 0 0 150127 1 0 0 0 0 150151 2 0 0 0 0 M END > BMDB0011985 > bmdb > CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@@]5(C[C@H](O)[C@@H](NC(C)=O)C(O5)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]4O)[C@H]3CC(C)=O)[C@H](O[C@@]3(C[C@H](O)[C@@H](NC(C)=O)C(O3)[C@H](O)[C@@H](CO)O[C@@]3(C[C@H](O)[C@@H](NC(C)=O)C(O3)[C@H](O)[C@H](O)CO)C(O)=O)C(O)=O)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCC\C=C/CCCCCCCC > InChI=1S/C100H172N4O47/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-28-30-32-34-36-38-40-70(122)104-58(59(116)39-37-35-33-31-29-27-20-18-16-14-12-10-8-2)52-138-92-80(129)79(128)84(68(50-110)141-92)144-94-82(131)90(151-100(97(136)137)44-62(119)73(103-56(6)115)88(149-100)78(127)67(49-109)146-98(95(132)133)42-60(117)71(101-54(4)113)86(147-98)74(123)63(120)45-105)85(69(51-111)142-94)145-91-57(41-53(3)112)83(76(125)65(47-107)139-91)143-93-81(130)89(77(126)66(48-108)140-93)150-99(96(134)135)43-61(118)72(102-55(5)114)87(148-99)75(124)64(121)46-106/h21-22,37,39,57-69,71-94,105-111,116-121,123-131H,7-20,23-36,38,40-52H2,1-6H3,(H,101,113)(H,102,114)(H,103,115)(H,104,122)(H,132,133)(H,134,135)(H,136,137)/b22-21-,39-37+/t57-,58+,59-,60+,61+,62+,63-,64-,65-,66-,67-,68-,69-,71-,72-,73-,74-,75-,76+,77+,78-,79-,80-,81-,82-,83-,84-,85+,86?,87?,88?,89+,90-,91+,92-,93+,94+,98-,99+,100+/m1/s1 > SHVMYHADOWAVOG-VUKIWEEHSA-N > C100H172N4O47 > 2182.4343 > 2181.119188758 > 47 > 234.37380386322928 > 0 > 29 > 0 > 0 > (2S,4S,5R)-2-{[(2R,3R,4S,5S,6R)-2-{[(2S,3R,4R,5R,6R)-2-{[(2R,3S,4R,5R,6S)-4-{[(2S,4S,5R)-2-carboxy-6-[(1S,2R)-2-{[(2S,4S,5R)-2-carboxy-5-acetamido-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy}-1,3-dihydroxypropyl]-5-acetamido-4-hydroxyoxan-2-yl]oxy}-6-{[(2R,3S,4R,5R,6R)-6-{[(2S,3R,4E)-2-[(13Z)-docos-13-enamido]-3-hydroxyoctadec-4-en-1-yl]oxy}-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-5-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-5-hydroxy-6-(hydroxymethyl)-3-(2-oxopropyl)oxan-4-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-5-acetamido-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid > 1.18 > -0.39045659166666696 > -3.68 > 1 > 7 > -3 > 2.818398623336933 > 2.31429534512401 > -3.9476121977780165 > 819.6500000000005 > 517.8953999999998 > 70 > 0 > 4.56e-01 g/l > (2S,4S,5R)-2-{[(2R,3R,4S,5S,6R)-2-{[(2S,3R,4R,5R,6R)-2-{[(2R,3S,4R,5R,6S)-4-{[(2S,4S,5R)-2-carboxy-6-[(1S,2R)-2-{[(2S,4S,5R)-2-carboxy-5-acetamido-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy}-1,3-dihydroxypropyl]-5-acetamido-4-hydroxyoxan-2-yl]oxy}-6-{[(2R,3S,4R,5R,6R)-6-{[(2S,3R,4E)-2-[(13Z)-docos-13-enamido]-3-hydroxyoctadec-4-en-1-yl]oxy}-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-5-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-5-hydroxy-6-(hydroxymethyl)-3-(2-oxopropyl)oxan-4-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-5-acetamido-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid > 0 > BMDB0011985 > Ganglioside GT1b (d18:1/22:1(13Z)) $$$$