Ketcher 12011712472D 1 1.00000 0.00000 0 28 29 0 1 0 999 V2000 9.8672 -5.0202 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8665 -6.0260 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9972 -6.5331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8682 -6.0241 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3691 -6.8926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1331 -3.0171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0002 -3.5177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -4.5195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1392 -5.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2721 -4.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2657 -3.5182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6847 -4.9957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5494 -5.5014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5444 -6.5034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6746 -6.9993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8098 -6.4934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 -5.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4133 -5.0089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4091 -7.0091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6695 -8.0010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9399 -6.9894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0869 -5.4935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 -3.9957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9569 -4.9974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8677 -3.0164 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1389 -6.0107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5371 -3.5221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4045 -3.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 4 2 2 0 0 0 5 2 2 0 0 0 6 7 1 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 9 10 1 0 0 0 10 11 1 0 0 0 11 6 1 0 0 0 12 13 1 0 0 0 13 14 1 0 0 0 14 15 1 0 0 0 15 16 1 0 0 0 16 17 1 0 0 0 17 12 1 0 0 0 24 23 2 0 0 0 28 27 1 0 0 0 24 22 1 0 0 0 13 18 1 1 0 0 15 20 1 1 0 0 16 21 1 6 0 0 14 19 1 6 0 0 17 24 1 6 0 0 10 18 1 6 0 0 9 26 1 1 0 0 11 28 1 1 0 0 8 1 1 6 0 0 7 25 1 6 0 0 M END > CHEBI:138716 > HP_dp02_0003 > A heparin disaccharide that is N-sulfo-α-D-glucosamine in which the hydroxy group at position 4 has been glycosylated by α-L-idopyranuronic acid. Sequence: IdoA-GlcNSO3. > 3 > alpha-L-IdopA(1-4)alpha-D-GlcpNS; alpha-L-IdopA(1-4)alpha-D-GlcpNS > 2-deoxy-4-O-alpha-L-idopyranuronosyl-2-(sulfoamino)-alpha-D-glucopyranose > C12H21NO14S > 435.360 > 435.06828 > 0 > N(S(O)(=O)=O)[C@H]1[C@H](O[C@@H]([C@H]([C@@H]1O)O[C@@H]2O[C@H]([C@H]([C@@H]([C@H]2O)O)O)C(=O)O)CO)O > InChI=1S/C12H21NO14S/c14-1-2-8(4(15)3(11(21)25-2)13-28(22,23)24)26-12-7(18)5(16)6(17)9(27-12)10(19)20/h2-9,11-18,21H,1H2,(H,19,20)(H,22,23,24)/t2-,3-,4-,5+,6+,7-,8-,9-,11+,12-/m1/s1 > KNKWELGWBDSUOG-PNRHKHKDSA-N > 14997572 $$$$