Marvin 06211311552D 46 46 0 0 1 0 999 V2000 13.4449 -44.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1594 -44.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8738 -44.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5882 -44.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3027 -44.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0171 -44.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7315 -44.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4460 -44.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1605 -44.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8749 -44.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5892 -44.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5892 -43.2914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.3037 -44.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0181 -44.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7326 -44.5288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.0181 -43.2914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.3037 -45.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5892 -45.7663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8749 -45.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1605 -45.7663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4460 -45.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7315 -45.7663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0171 -45.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3027 -45.7663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5882 -45.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8738 -45.7663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1594 -45.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4449 -45.7663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7304 -44.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0160 -44.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3014 -44.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5870 -44.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7304 -45.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0160 -45.7663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.5905 -44.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.5905 -45.3538 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 24.8760 -44.1163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.8760 -45.7663 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 24.1616 -44.5288 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 24.1616 -45.3538 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 26.3050 -44.1163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.3050 -45.7663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.8760 -46.5913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.4471 -45.7663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.4470 -44.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8725 -44.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 13 17 1 0 0 0 0 1 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 28 33 1 0 0 0 0 33 34 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 36 38 1 0 0 0 0 37 39 1 0 0 0 0 38 40 1 0 0 0 0 39 40 1 0 0 0 0 35 41 1 0 0 0 0 36 42 1 6 0 0 0 38 43 1 1 0 0 0 40 44 1 6 0 0 0 39 45 1 1 0 0 0 15 45 1 0 0 0 0 32 46 1 0 0 0 0 M END > CHEBI:74256 > 6-deoxy-D-glucos-6-yl corynomycolate > A mycolate ester formed by esterification of corynomycolic acid with the 6-OH of D-glucose. (C32 is the average tail length of a reported naturally occurring range of 30-36 carbon atoms.) > 3 > glucose monomycolate (C32); glucose MM (C32); glucose 6-O-monomycolate; C32-GMM; C32 GMM; C32 glucose MM > 6-O-(3-hydroxy-2-tetradecyloctadecanoyl)-D-glucopyranose > C38H74O8 > 658.98940 > 658.53837 > 0 > CCCCCCCCCCCCCCCC(O)C(CCCCCCCCCCCCCC)C(=O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O > InChI=1S/C38H74O8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-32(39)31(28-26-24-22-20-18-16-14-12-10-8-6-4-2)37(43)45-30-33-34(40)35(41)36(42)38(44)46-33/h31-36,38-42,44H,3-30H2,1-2H3/t31?,32?,33-,34-,35+,36-,38?/m1/s1 > AQVWXIRCPXPVPT-UNCJEZMPSA-N > 23727893; 27807341 $$$$