HMDB0006598 RDKit 3D Isoglobotriaose 68 69 0 0 0 0 0 0 0 0999 V2000 6.5454 2.8020 -0.2642 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7274 1.7134 0.2442 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5901 0.7971 0.5037 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0740 -0.3538 1.0795 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9128 0.5531 -0.8238 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8520 -0.0123 -1.6804 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6832 -0.3243 -0.7148 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7341 0.2214 0.1377 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5639 0.6292 -0.5056 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5712 1.9942 -0.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4029 2.6523 -0.3876 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6664 4.1059 -0.0396 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3151 4.1502 1.1884 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3902 2.0712 0.7914 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4678 1.8823 1.8708 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8295 0.7195 0.3151 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6709 0.0763 1.2083 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9504 -0.1313 0.6733 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2623 -1.5799 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6753 -1.9658 0.4849 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9580 -2.3612 -0.9706 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2926 -2.7279 -1.1362 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7068 -0.9763 0.8822 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.9068 -1.1233 0.1867 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2782 0.4626 0.7194 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1014 0.8013 -0.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9875 0.5994 1.5030 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.1408 -0.1661 2.6822 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3709 -0.0801 -0.0459 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0618 -1.0390 -0.9936 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0335 -1.7503 -0.4179 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0051 -2.1523 -1.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8654 -2.6798 -0.6293 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2728 -4.0184 -0.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7222 1.3945 0.5158 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9105 1.3663 1.2026 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0217 -0.4532 0.8417 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6706 1.5503 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5675 -0.4302 -1.1458 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2317 -0.3056 -1.7466 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7306 0.3773 -1.5963 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1998 2.5426 -1.3038 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3023 4.6563 0.0319 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 4.6058 -0.8053 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6558 4.2147 1.9466 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2026 2.7663 0.9957 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3879 0.9559 2.2343 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4337 0.8984 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9986 0.2679 -0.3465 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8082 -2.0432 1.5669 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6777 -2.0358 -0.2028 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8592 -2.9027 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 -3.2438 -1.2046 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7149 -1.5176 -1.6542 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7043 -2.2275 -1.8848 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9690 -1.0968 1.9687 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3221 -0.2738 -0.0612 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0853 1.0829 1.1827 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6594 1.6968 -0.6161 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7180 1.6281 1.7285 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2904 -0.0883 3.1593 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6379 -0.6880 0.8634 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3123 -1.8785 -0.5707 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4259 -1.9301 0.5814 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5891 -2.5608 -2.1544 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4502 -2.6466 -1.6555 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0264 -2.4643 0.0651 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8281 -4.0063 0.4216 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 3 5 1 0 5 6 1 0 5 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 11 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 20 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 16 29 1 0 29 30 1 0 7 31 1 0 31 32 1 0 31 33 1 0 33 34 1 0 29 9 1 0 27 18 1 0 2 35 1 0 3 36 1 1 4 37 1 0 5 38 1 6 6 39 1 0 7 40 1 6 9 41 1 6 11 42 1 6 12 43 1 0 12 44 1 0 13 45 1 0 14 46 1 1 15 47 1 0 16 48 1 6 18 49 1 6 19 50 1 0 19 51 1 0 20 52 1 1 21 53 1 0 21 54 1 0 22 55 1 0 23 56 1 1 24 57 1 0 25 58 1 1 26 59 1 0 27 60 1 1 28 61 1 0 29 62 1 1 30 63 1 0 31 64 1 1 32 65 1 0 33 66 1 0 33 67 1 0 34 68 1 0 M END