Marvin 10261210492D 44 46 0 0 1 0 999 V2000 11.4430 -6.4565 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.4430 -7.2815 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7286 -6.0440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7286 -7.6940 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0141 -6.4565 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0141 -7.2815 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7286 -8.5190 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2997 -7.6940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0142 -8.9315 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2997 -8.5190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2997 -6.0440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5853 -6.4565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4430 -4.8066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1576 -6.0440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1576 -7.6940 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8720 -7.2815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5865 -7.6940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8720 -6.4565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0142 -9.7565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2997 -10.1689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6828 -4.7342 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.6828 -3.9092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4673 -4.9891 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 16.4673 -3.6542 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 16.9524 -4.3217 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 16.7223 -5.7736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7223 -2.8696 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.7773 -4.3217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1703 -2.2566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5294 -2.6981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4253 -1.4719 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.3634 -2.4280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7842 -1.9135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2322 -1.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4871 -0.5158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8720 -4.8066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5864 -6.0440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3009 -4.8066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1576 -5.2191 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 12.1576 -4.3941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5864 -5.2191 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 13.5864 -4.3941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0154 -5.2191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7287 -10.1689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 6 0 0 0 1 2 1 0 0 0 0 2 15 1 6 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 4 7 1 1 0 0 0 3 5 1 0 0 0 0 5 11 1 1 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 6 8 1 6 0 0 0 9 7 1 0 0 0 0 9 19 1 0 0 0 0 9 10 1 1 0 0 0 11 12 1 0 0 0 0 13 39 2 0 0 0 0 39 14 1 0 0 0 0 15 16 1 0 0 0 0 16 18 2 0 0 0 0 16 17 1 0 0 0 0 19 44 1 0 0 0 0 19 20 2 0 0 0 0 21 43 1 1 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 6 0 0 0 24 27 1 1 0 0 0 24 25 1 0 0 0 0 25 28 1 6 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 2 0 0 0 0 30 33 2 0 0 0 0 31 34 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 39 36 1 0 0 0 0 36 41 1 0 0 0 0 41 37 2 0 0 0 0 41 38 1 0 0 0 0 38 43 1 0 0 0 0 39 40 1 0 0 0 0 41 42 1 0 0 0 0 M END > CHEBI:70765 > UDP-N-acetyl-alpha-D-muramic acid > A UDP-N-acetyl-D-muramate in which the anomeric centre of the pyranose fragment has α-configuration. > 3 > UDP-N-acetylmuramic acid; UDP-MurNAc > uridine 5'-(3-{2-acetylamino-3-O-[(R)-1-carboxyethyl]-2-deoxy-alpha-D-glucopyranosyl} dihydrogen diphosphate) > C20H31N3O19P2 > 679.41640 > 679.10270 > 0 > C[C@@H](O[C@H]1[C@H](O)[C@@H](CO)O[C@H](OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)[C@@H]1NC(C)=O)C(O)=O > InChI=1S/C20H31N3O19P2/c1-7(18(30)31)38-16-12(21-8(2)25)19(40-9(5-24)14(16)28)41-44(35,36)42-43(33,34)37-6-10-13(27)15(29)17(39-10)23-4-3-11(26)22-20(23)32/h3-4,7,9-10,12-17,19,24,27-29H,5-6H2,1-2H3,(H,21,25)(H,30,31)(H,33,34)(H,35,36)(H,22,26,32)/t7-,9-,10-,12-,13-,14-,15-,16-,17-,19-/m1/s1 > NQBRVZNDBBMBLJ-MQTLHLSBSA-N > 77166 > C01050 > C00019555 > UDP-N-ACETYLMURAMATE > EPZ $$$$