HMDB0013645 RDKit 3D N,N-Dimethylsphingosine 64 63 0 0 0 0 0 0 0 0999 V2000 -8.8877 0.8924 -0.4076 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8654 0.9116 -1.5366 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1325 -0.3985 -1.4934 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4434 -0.6111 -0.1692 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4414 0.4740 0.0696 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7219 0.3192 1.3712 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 -0.9626 1.4373 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9439 -1.1467 0.3639 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8675 -0.0871 0.3731 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1047 -0.0466 1.6594 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0272 0.9703 1.7336 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0584 0.8365 0.7057 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7805 -0.4861 0.7868 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8225 -0.4998 -0.2785 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1208 -0.6362 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1984 -0.6569 -1.0092 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8913 0.3061 -1.9758 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4942 -0.3054 -0.3431 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3477 1.0308 0.3518 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0288 2.0351 -0.5573 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5362 -0.2768 -1.3452 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7824 0.2493 -0.7912 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7314 -1.6043 -1.8503 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3684 1.1542 0.5137 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2610 -0.1562 -0.3379 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7174 1.5940 -0.6365 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3993 1.0284 -2.5221 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1822 1.7503 -1.3585 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3961 -0.4445 -2.3317 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8169 -1.2665 -1.6384 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2027 -0.6571 0.6416 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8566 -1.5752 -0.1903 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6697 0.5296 -0.7274 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9220 1.4975 0.1201 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4360 0.3334 2.2282 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0848 1.2184 1.5004 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5109 -1.1035 2.4692 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6865 -1.8044 1.3751 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4572 -1.1032 -0.6111 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5072 -2.1692 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2468 -0.2449 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4027 0.8902 0.2069 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8236 0.1592 2.4805 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6952 -1.0588 1.8506 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4536 0.8860 2.7303 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 2.0058 1.6701 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8257 1.6121 0.9649 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7302 1.0813 -0.3184 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3068 -0.5462 1.7602 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1204 -1.3571 0.6103 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5859 -0.4009 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3581 -0.7362 1.0632 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2364 -1.6190 -1.5606 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2351 0.9874 -1.6298 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7937 -1.0436 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2536 1.2857 0.9425 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5086 0.9417 1.0656 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7419 2.8417 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5575 0.1132 -1.5643 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5894 1.3293 -0.6104 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0175 -0.3000 0.1342 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7919 -1.9134 -1.6474 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1159 -2.3171 -1.2685 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4618 -1.7299 -2.9208 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 19 20 1 0 18 21 1 0 21 22 1 0 21 23 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 0 2 28 1 0 3 29 1 0 3 30 1 0 4 31 1 0 4 32 1 0 5 33 1 0 5 34 1 0 6 35 1 0 6 36 1 0 7 37 1 0 7 38 1 0 8 39 1 0 8 40 1 0 9 41 1 0 9 42 1 0 10 43 1 0 10 44 1 0 11 45 1 0 11 46 1 0 12 47 1 0 12 48 1 0 13 49 1 0 13 50 1 0 14 51 1 0 15 52 1 0 16 53 1 6 17 54 1 0 18 55 1 1 19 56 1 0 19 57 1 0 20 58 1 0 22 59 1 0 22 60 1 0 22 61 1 0 23 62 1 0 23 63 1 0 23 64 1 0 M END