Marvin 03161115232D 54 58 0 0 1 0 999 V2000 7.5798 -17.2704 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3131 -17.6370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7549 -17.6370 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7549 -18.5536 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0216 -17.2704 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2883 -17.6370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0216 -16.3537 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2883 -15.8955 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7549 -15.8955 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5798 -16.3537 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7549 -15.0706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8043 -15.0706 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.8043 -15.9872 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.3379 -15.9872 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.0712 -16.3537 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.6046 -16.3537 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.0712 -14.7039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3379 -15.0706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0712 -17.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6046 -17.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3379 -17.6370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8043 -14.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6046 -15.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7797 -15.9872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7797 -17.6370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0463 -16.3537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0463 -17.2704 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.0712 -15.5288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3379 -16.8122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8043 -16.8122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6762 -14.7874 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.2149 -15.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6763 -16.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6762 -13.8709 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.2344 -13.8709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4094 -13.5040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9430 -13.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9676 -13.5040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7009 -13.9624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4342 -13.5040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7009 -14.7874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4094 -14.3290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4724 -14.6551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9013 -13.8302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9013 -14.6551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1868 -13.4177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1868 -15.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4724 -13.8302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7579 -13.4177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1869 -15.8925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7585 -12.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4741 -12.1852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1898 -12.6027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9091 -12.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 1 0 0 0 3 1 1 0 0 0 0 10 1 1 0 0 0 0 27 2 1 1 0 0 0 3 4 1 6 0 0 0 5 3 1 0 0 0 0 5 6 1 1 0 0 0 7 5 1 0 0 0 0 7 8 1 1 0 0 0 9 7 1 0 0 0 0 10 9 1 0 0 0 0 9 11 1 1 0 0 0 17 12 1 0 0 0 0 12 22 1 1 0 0 0 13 30 1 6 0 0 0 15 13 1 0 0 0 0 16 14 1 0 0 0 0 15 14 1 0 0 0 0 14 29 1 6 0 0 0 18 14 1 0 0 0 0 19 15 1 0 0 0 0 15 28 1 1 0 0 0 20 16 1 0 0 0 0 16 23 1 1 0 0 0 24 16 1 0 0 0 0 18 17 1 0 0 0 0 21 19 1 0 0 0 0 25 20 1 0 0 0 0 21 20 2 0 0 0 0 26 24 1 0 0 0 0 27 25 1 0 0 0 0 27 26 1 0 0 0 0 31 12 1 0 0 0 0 13 12 1 0 0 0 0 32 31 1 0 0 0 0 33 13 1 0 0 0 0 33 32 1 0 0 0 0 34 31 1 0 0 0 0 31 42 1 6 0 0 0 36 34 1 0 0 0 0 34 37 1 6 0 0 0 36 35 1 0 0 0 0 38 35 1 0 0 0 0 39 38 1 0 0 0 0 40 39 1 0 0 0 0 41 39 1 0 0 0 0 11 43 1 0 0 0 0 45 44 1 0 0 0 0 46 44 1 0 0 0 0 47 45 1 0 0 0 0 43 47 1 0 0 0 0 48 46 1 0 0 0 0 49 48 1 0 0 0 0 47 50 2 0 0 0 0 49 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 M END > CHEBI:61649 > cholesteryl 6-O-decanoyl-beta-D-galactoside > A cholesteryl 6-O-acyl-β-D-galactoside having decanoyl as the 6-O-acyl group. > 3 > cholesteryl 6-O-decanoyl-beta-D-galactopyranoside; cholesteryl 6-O-capryl-beta-D-galactopyranoside; cholest-5-en-3beta-yl 6-O-decanoyl-beta-D-galactoside; ACGal C10 > cholest-5-en-3beta-yl 6-O-decanoyl-beta-D-galactopyranoside > C43H74O7 > 703.04350 > 702.54345 > 0 > [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)O[C@@H]1O[C@H](COC(=O)CCCCCCCCC)[C@H](O)[C@H](O)[C@H]1O)[C@H](C)CCCC(C)C > InChI=1S/C43H74O7/c1-7-8-9-10-11-12-13-17-37(44)48-27-36-38(45)39(46)40(47)41(50-36)49-31-22-24-42(5)30(26-31)18-19-32-34-21-20-33(29(4)16-14-15-28(2)3)43(34,6)25-23-35(32)42/h18,28-29,31-36,38-41,45-47H,7-17,19-27H2,1-6H3/t29-,31+,32+,33-,34+,35+,36-,38+,39+,40-,41-,42+,43-/m1/s1 > FOCCPGVCDPXOQU-DIDMLHEZSA-N > 20379966 > 20143357 $$$$