Marvin 11091210482D 51 53 0 0 1 0 999 V2000 10.5928 -6.1904 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.5928 -7.0150 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.5414 -5.4920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8690 -5.7798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8690 -7.4292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.2853 -4.9120 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1703 -6.1904 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1703 -7.0150 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.2853 -4.0909 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.9839 -5.3298 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4537 -5.7834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9711 -7.9190 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9839 -3.6803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5688 -3.6803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7113 -4.9120 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.9984 -6.1976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7371 -6.1940 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.4465 -4.9553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2580 -8.3296 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.7113 -4.0909 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.4280 -5.3298 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2580 -9.1578 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5344 -7.9190 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5344 -9.5719 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8213 -8.3296 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8213 -9.1578 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5595 -10.5044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1154 -7.9190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1154 -9.5719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8556 -4.0953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1395 -3.6850 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.7291 -4.4012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5495 -2.9687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4232 -3.2749 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.8627 -8.2543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3066 -7.4290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1314 -7.4290 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.9563 -7.4290 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 12.1314 -8.2539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1314 -6.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9716 -9.5715 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3998 -8.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7795 -4.0343 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4246 -6.1548 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.2496 -6.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5994 -6.1513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4210 -6.9799 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.9761 -11.0878 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5595 -11.6712 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3928 -11.6712 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.3928 -10.5044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 1 0 0 0 1 4 1 0 0 0 0 2 5 1 0 0 0 0 6 3 1 6 0 0 0 4 7 1 0 0 0 0 5 8 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 7 11 1 6 0 0 0 8 12 1 6 0 0 0 9 13 1 0 0 0 0 9 14 1 1 0 0 0 10 15 1 0 0 0 0 10 16 1 1 0 0 0 11 17 1 0 0 0 0 11 18 2 0 0 0 0 19 12 1 6 0 0 0 13 20 1 0 0 0 0 15 21 1 6 0 0 0 19 22 1 0 0 0 0 19 23 1 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 1 0 0 0 25 28 1 1 0 0 0 26 29 1 6 0 0 0 7 8 1 0 0 0 0 15 20 1 0 0 0 0 25 26 1 0 0 0 0 14 30 1 0 0 0 0 32 31 2 0 0 0 0 33 31 2 0 0 0 0 34 31 1 0 0 0 0 30 31 1 0 0 0 0 5 35 1 1 0 0 0 2 36 1 6 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 39 37 2 0 0 0 0 37 40 2 0 0 0 0 22 41 1 6 0 0 0 28 42 1 0 0 0 0 20 43 1 6 0 0 0 45 44 2 0 0 0 0 46 44 2 0 0 0 0 47 44 1 0 0 0 0 21 44 1 0 0 0 0 27 48 1 0 0 0 0 48 49 2 0 0 0 0 48 50 1 0 0 0 0 48 51 2 0 0 0 0 M CHG 6 17 -1 34 -1 38 -1 41 1 47 -1 50 -1 M STY 1 1 SRU M SCN 1 1 HT M SAL 1 15 12 8 5 35 2 36 37 40 39 38 7 11 18 17 4 M SAL 1 15 1 3 13 32 33 34 31 30 14 9 6 16 10 45 46 M SAL 1 5 47 44 21 15 20 M SDI 1 4 14.5516 -3.6552 14.5742 -4.4799 M SDI 1 4 7.8833 -8.4455 7.4716 -7.7306 M SBL 1 2 18 45 M SMT 1 n M END > CHEBI:70975 > heparan sulfate alpha-D-glucosaminide 3-sulfate polyanion > A carbohydrate acid derivative anion arising from deprotonation of the carboxylic acid and sulfate groups of the repeating units of heparan sulfate α-D-glucosaminide 3-sulfate; major species at pH 7.3. > 3 > heparan sulfate alpha-D-glucosaminide 3-sulfate anion; heparan sulfate alpha-D-glucosaminide 3-sulfate > C6H13NO8S(C12H15NO19S3)n $$$$