HMDB0000596 RDKit 3D Glucosylsphingosine 79 79 0 0 0 0 0 0 0 0999 V2000 7.7885 2.0008 3.7821 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3283 2.4504 2.4374 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2552 2.2608 1.3562 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9307 0.7932 1.3413 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8636 0.4715 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 0.8458 -1.0837 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2341 0.5274 -2.0673 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9077 -0.9494 -2.0588 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8159 -1.1348 -3.1104 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4385 -2.5777 -3.1842 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9174 -3.0901 -1.8893 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6882 -2.3476 -1.4048 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5644 -2.4742 -2.4252 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6371 -1.7603 -1.9713 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7546 -1.0976 -0.8483 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0029 -0.3876 -0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7305 0.0486 -1.5382 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7912 -1.3557 0.4127 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1214 -2.4935 -0.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 -0.7289 1.0223 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9116 -0.2632 0.0957 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9964 0.2925 0.7711 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0761 1.6240 0.3687 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8892 2.3693 1.2230 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.9804 2.9905 2.2696 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0617 3.7988 1.5905 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8765 1.4809 1.9542 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.9309 2.3110 2.3727 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4177 0.3960 1.0799 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.2279 -0.4263 1.8782 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2869 -0.3875 0.4517 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.5317 -0.4369 -0.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4548 2.4691 4.5519 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8609 0.8844 3.8176 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7387 2.3104 3.8891 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2158 1.8638 2.1375 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5986 3.5245 2.4271 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6501 2.6591 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3731 2.8424 1.6895 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8450 0.2156 1.0608 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5252 0.5145 2.3194 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6983 -0.6245 0.3879 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9213 0.9541 0.5968 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2189 0.2492 -1.3413 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5795 1.9211 -1.1314 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2715 1.0550 -1.8238 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5511 0.8545 -3.0827 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7860 -1.5813 -2.2505 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4919 -1.2361 -1.0606 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9784 -0.4839 -2.7834 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1801 -0.8149 -4.1074 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3307 -3.1827 -3.4532 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -2.7328 -4.0146 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6928 -3.0555 -1.1177 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6851 -4.1893 -2.0075 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9373 -1.2992 -1.1767 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3543 -2.8405 -0.4703 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -2.1260 -3.4211 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3086 -3.5646 -2.4607 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5112 -1.7840 -2.6288 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0935 -1.0560 -0.1765 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7086 0.5021 0.1495 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1962 -0.6923 -1.9987 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1358 -1.7069 1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9859 -2.3748 -0.9678 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0225 -3.3707 0.0935 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5317 -1.5501 1.5924 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6993 0.0132 1.7682 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8522 0.2151 1.8781 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4300 3.1203 0.6406 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3855 2.1880 2.7509 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5781 3.5737 3.0102 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3824 4.1247 2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4006 1.1001 2.8739 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7765 1.8036 2.4485 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0823 0.8515 0.3158 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1273 -1.3642 1.5727 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3407 -1.4252 0.8629 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5793 0.4951 -1.2578 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 24 27 1 0 27 28 1 0 27 29 1 0 29 30 1 0 29 31 1 0 31 32 1 0 31 22 1 0 1 33 1 0 1 34 1 0 1 35 1 0 2 36 1 0 2 37 1 0 3 38 1 0 3 39 1 0 4 40 1 0 4 41 1 0 5 42 1 0 5 43 1 0 6 44 1 0 6 45 1 0 7 46 1 0 7 47 1 0 8 48 1 0 8 49 1 0 9 50 1 0 9 51 1 0 10 52 1 0 10 53 1 0 11 54 1 0 11 55 1 0 12 56 1 0 12 57 1 0 13 58 1 0 13 59 1 0 14 60 1 0 15 61 1 0 16 62 1 0 17 63 1 0 18 64 1 0 19 65 1 0 19 66 1 0 20 67 1 0 20 68 1 0 22 69 1 0 24 70 1 6 25 71 1 0 25 72 1 0 26 73 1 0 27 74 1 1 28 75 1 0 29 76 1 6 30 77 1 0 31 78 1 1 32 79 1 0 M END