Ketcher 05042309362D 1 1.00000 0.00000 0 28 29 0 1 0 999 V2000 10.0400 -8.5183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7859 -6.3652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7859 -7.2264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0399 -5.9346 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0400 -7.6570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2943 -6.3652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2943 -7.2264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5316 -7.6570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5482 -7.6570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5483 -5.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8025 -6.3653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5836 -5.3018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7152 -3.1929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7152 -4.0540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9694 -2.7623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9694 -4.4846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2235 -3.1929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2235 -4.0540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4610 -2.7623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9693 -5.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4776 -4.4846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4776 -2.7623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3922 -2.7614 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 6.2756 -7.6756 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 8.5482 -5.0736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1739 -9.0183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1739 -10.0183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3079 -8.5183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 2 4 1 0 0 0 3 5 1 0 0 0 4 6 1 0 0 0 5 7 1 0 0 0 6 7 1 0 0 0 3 8 1 6 0 0 5 1 1 1 0 0 7 9 1 1 0 0 6 10 1 1 0 0 10 11 1 0 0 0 2 12 1 6 0 0 13 14 1 0 0 0 13 15 1 0 0 0 14 16 1 0 0 0 15 17 1 0 0 0 16 18 1 0 0 0 17 18 1 0 0 0 13 19 1 6 0 0 14 12 1 6 0 0 16 20 1 6 0 0 18 21 1 1 0 0 17 22 1 6 0 0 19 23 1 0 0 0 9 24 1 0 0 0 10 25 2 0 0 0 1 26 1 0 0 0 26 27 2 0 0 0 26 28 1 0 0 0 M STY 1 1 SRU M SLB 1 1 1 M SCN 1 1 HT M SMT 1 n M SAL 1 15 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 M SAL 1 11 16 17 18 19 20 21 22 25 26 27 28 M SBL 1 2 24 25 M SDI 1 4 11.9022 -2.2257 12.9510 -3.2980 M SDI 1 4 7.9363 -8.2025 6.8875 -7.1301 M END > CHEBI:137415 > 3-O-acetylated rhamnogalacturonan I > A galacturonan derivative obtained by acetylation at position 3 of galacturonyl residues of rhamnogalacturonan I. A representative structure is shown. > 3 > [(->4)-alpha-D-GalpA3Ac-(l->2)-alpha-L-Rhap(1->)]n > (C14H20O12)n > 0 > RXN-12098 > 25843854 $$$$