CDK 1029232201 59 60 0 0 0 0 0 0 0 0999 V2000 13.5752 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5752 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8608 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2898 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1462 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0042 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1462 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4318 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7187 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8608 1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7173 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4332 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8608 2.0625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0028 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1477 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5752 2.4751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1462 2.4751 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2883 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8622 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5752 3.3001 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4318 2.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1462 3.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5739 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5767 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8608 3.7126 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.2898 3.7126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4318 3.7126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8593 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2911 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8608 4.5376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2898 4.5376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4318 4.5376 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1449 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0056 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1462 4.9501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7173 4.9501 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4304 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7201 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1462 5.7751 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0028 4.5376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7173 5.7751 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7159 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4346 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4318 6.1876 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.8608 6.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0028 6.1876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0014 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1491 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4318 7.0127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8608 7.0127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2869 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8636 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.5781 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1435 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 4 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 6 9 1 0 0 0 0 7 10 1 0 0 0 0 8 11 1 0 0 0 0 9 12 1 0 0 0 0 13 10 1 6 0 0 0 11 14 1 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 17 13 1 0 0 0 0 14 18 1 0 0 0 0 15 19 1 0 0 0 0 20 16 1 0 0 0 0 17 21 1 6 0 0 0 17 22 1 0 0 0 0 18 23 1 0 0 0 0 19 24 1 0 0 0 0 25 20 1 0 0 0 0 20 26 1 1 0 0 0 22 27 1 0 0 0 0 23 28 1 0 0 0 0 24 29 1 0 0 0 0 25 30 1 6 0 0 0 26 31 1 0 0 0 0 32 27 1 6 0 0 0 28 33 1 0 0 0 0 29 34 1 0 0 0 0 32 35 1 0 0 0 0 36 32 1 0 0 0 0 33 37 1 0 0 0 0 34 38 1 0 0 0 0 39 35 1 0 0 0 0 36 40 1 6 0 0 0 41 36 1 0 0 0 0 37 42 1 0 0 0 0 38 43 1 0 0 0 0 44 39 1 0 0 0 0 39 45 1 1 0 0 0 41 46 1 1 0 0 0 42 47 1 0 0 0 0 43 48 1 0 0 0 0 44 49 1 6 0 0 0 45 50 1 0 0 0 0 47 51 1 0 0 0 0 48 52 1 0 0 0 0 51 53 1 0 0 0 0 52 54 1 0 0 0 0 53 55 1 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 58 59 1 0 0 0 0 22 25 1 0 0 0 0 41 44 1 0 0 0 0 M END > CHEBI:202890 > Glycolipid G2 > 2 > [1-[(2S,3R,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-pentadecoxypropan-2-yl] pentadecanoate > C45H86O14 > 851.169 > 850.60176 > 0 > O=C(OC(CO[C@H]1O[C@@H]([C@@H](O)C([C@H]1O)O[C@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)CO)CO)COCCCCCCCCCCCCCCC)CCCCCCCCCCCCCC > InChI=1S/C45H86O14/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-54-32-34(56-37(48)28-26-24-22-20-18-16-14-12-10-8-6-4-2)33-55-44-42(53)43(39(50)36(31-47)57-44)59-45-41(52)40(51)38(49)35(30-46)58-45/h34-36,38-47,49-53H,3-33H2,1-2H3/t34?,35-,36-,38-,39-,40+,41-,42-,43?,44+,45-/m1/s1 > YKQIZMFHBJKOKA-CAQVYKBTSA-N $$$$