Ketcher 05082013412D 1 1.00000 0.00000 0 34 36 0 1 0 999 V2000 11.4083 -8.7452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8703 -8.7509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1404 -6.7454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5424 -7.2454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9939 -10.2494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1404 -9.7451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8724 -6.7454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6764 -9.7451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5934 -9.7571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9446 -8.7452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5875 -11.7570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9446 -6.7454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8526 -12.7518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4083 -5.7454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8105 -5.2455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1206 -12.7467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2744 -8.2453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1404 -8.7452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0063 -8.2453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2744 -7.2454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0063 -7.2454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5424 -8.2453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8615 -9.7520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6764 -8.7452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7259 -10.2545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8105 -8.2453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7230 -11.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8105 -7.2454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6764 -6.7454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8555 -11.7518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9910 -11.2493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4083 -6.7454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6764 -5.7454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1235 -11.7468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17 1 1 6 0 0 22 1 1 6 0 0 19 2 1 1 0 0 23 2 1 6 0 0 3 20 1 0 0 0 3 21 1 0 0 0 4 22 1 0 0 0 4 29 1 0 0 0 5 23 1 0 0 0 5 31 1 0 0 0 18 6 1 1 0 0 21 7 1 6 0 0 24 8 1 1 0 0 25 9 1 1 0 0 26 10 1 1 0 0 27 11 1 1 0 0 28 12 1 6 0 0 30 13 1 6 0 0 14 32 1 0 0 0 15 33 1 0 0 0 16 34 1 0 0 0 17 18 1 0 0 0 17 20 1 0 0 0 18 19 1 0 0 0 19 21 1 0 0 0 20 32 1 1 0 0 22 24 1 0 0 0 23 25 1 0 0 0 24 26 1 0 0 0 25 27 1 0 0 0 26 28 1 0 0 0 27 30 1 0 0 0 28 29 1 0 0 0 29 33 1 1 0 0 30 31 1 0 0 0 31 34 1 1 0 0 M END > CHEBI:146657 > alpha-D-Manp-(1->2)-[alpha-D-Manp-(1->4)]-alpha-D-Manp > A mannotriose that is α-D-mannopyranose in which the hydroxy groups at positions 2 and 4 have each been converted into the corresponding α-D-mannopyranoside. > 3 > WURCS=2.0/1,3,2/[a1122h-1a_1-5]/1-1-1/a2-b1_a4-c1; alpha-D-manno-hexopyranosyl-(1->2)-[alpha-D-manno-hexopyranosyl-(1->4)]-alpha-D-manno-hexopyranose; (2R,3S,4S,5S,6R)-2-[(2R,3S,4S,5S,6S)-4,6-dihydroxy-2-(hydroxymethyl)-5-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol > Man(a1-2)[Man(a1-4)]a-Man; alpha-D-mannopyranosyl-(1->2)-[alpha-D-mannopyranosyl-(1->4)]-alpha-D-mannopyranose > C18H32O16 > 504.438 > 504.16903 > 0 > O([C@H]1[C@H](O)[C@H](O[C@H]2O[C@@H]([C@@H](O)[C@H](O)[C@@H]2O)CO)[C@H](O[C@@H]1CO)O)[C@H]3O[C@@H]([C@@H](O)[C@H](O)[C@@H]3O)CO > InChI=1S/C18H32O16/c19-1-4-7(22)9(24)11(26)17(31-4)33-14-6(3-21)30-16(29)15(13(14)28)34-18-12(27)10(25)8(23)5(2-20)32-18/h4-29H,1-3H2/t4-,5-,6-,7-,8-,9+,10+,11+,12+,13+,14-,15+,16+,17-,18-/m1/s1 > GRDHQWBQPQWUOG-KEUJIGTJSA-N $$$$