Ketcher 12101516432D 1 1.00000 0.00000 0 34 34 0 1 0 999 V2000 9.0295 -12.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0295 -11.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8956 -13.2800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7616 -12.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7616 -11.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8956 -11.2801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1636 -13.2800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1636 -11.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6276 -11.2801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6276 -13.2800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2976 -11.7800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4936 -11.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3597 -11.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2258 -11.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3597 -10.2800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0917 -11.2801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8956 -14.2800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4933 -9.7803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4923 -8.7804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6261 -8.2810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6250 -7.2810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7588 -6.7814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7577 -5.7815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8915 -5.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8903 -4.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7561 -3.7812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7554 -2.7813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6214 -2.2804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4878 -2.7796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3534 -2.2789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2201 -2.7783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6276 -10.2811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2209 -3.7784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0874 -4.2777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 1 0 0 1 2 1 0 0 0 2 8 1 1 0 0 3 1 1 0 0 0 3 17 1 1 0 0 3 4 1 0 0 0 4 10 1 6 0 0 4 5 1 0 0 0 5 9 1 1 0 0 2 6 1 0 0 0 5 6 1 0 0 0 8 11 1 0 0 0 9 12 1 0 0 0 13 12 1 0 0 0 13 14 1 0 0 0 13 15 1 6 0 0 14 16 1 0 0 0 15 18 1 0 0 0 18 19 1 0 0 0 19 20 1 0 0 0 20 21 1 0 0 0 21 22 1 0 0 0 22 23 1 0 0 0 23 24 1 0 0 0 25 24 2 0 0 0 26 25 1 0 0 0 27 26 1 0 0 0 28 27 2 0 0 0 29 28 1 0 0 0 30 29 1 0 0 0 31 30 2 0 0 0 18 32 2 0 0 0 31 33 1 0 0 0 33 34 1 0 0 0 M END > CHEBI:90578 > 2-(7Z,10Z,13Z)-hexadecatrienoyl-3-(beta-D-galactosyl)-sn-glycerol > A 2-acyl-3-(β-D-galactosyl)-sn-glycerol in which the acyl group at the 2 position is specified as (7Z,10Z,13Z)-hexadecatrienoyl. > 3 > 2-(7Z,10Z,13Z)-hexadecatrienoyl-3-O-(beta-D-galactosyl)-sn-glycerol > (2R)-1-(beta-D-galactopyranosyloxy)-3-hydroxypropan-2-yl (7Z,10Z,13Z)-hexadeca-7,10,13-trienoate > C25H42O9 > 486.597 > 486.28288 > 0 > [C@H]1(O)[C@@H](CO)O[C@H]([C@@H]([C@H]1O)O)OC[C@@H](CO)OC(CCCCC/C=C\C/C=C\C/C=C\CC)=O > InChI=1S/C25H42O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21(28)33-19(16-26)18-32-25-24(31)23(30)22(29)20(17-27)34-25/h3-4,6-7,9-10,19-20,22-27,29-31H,2,5,8,11-18H2,1H3/b4-3-,7-6-,10-9-/t19-,20-,22+,23+,24-,25-/m1/s1 > LJVATEUJGAWSPM-DKFDWSOISA-N > 11278736 $$$$