Mrv0541 02231220032D 67 69 0 0 1 0 999 V2000 15.1568 -8.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4511 -11.1837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0213 -11.1837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6030 -12.8272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8810 -9.5402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1655 -12.8272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0213 -13.6524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4511 -12.8272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3068 -9.5402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8810 -12.0088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3068 -11.1837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6030 -14.4706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1731 -15.2958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7473 -14.4706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9803 -11.7105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8284 -10.0672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1247 -13.3540 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4660 -10.7564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4321 -7.4585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7280 -8.7019 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3104 -12.4181 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7437 -11.5852 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0213 -12.8272 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7437 -12.4181 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1660 -10.7746 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3104 -11.5852 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8810 -11.1837 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8840 -13.2287 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1660 -9.9452 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.6029 -10.7746 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.6029 -9.9452 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8840 -14.0505 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1655 -14.4706 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4657 -14.0505 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4657 -13.2287 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6030 -11.1837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4587 -9.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7473 -12.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0243 -9.9456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7349 -9.5265 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.4591 -9.9284 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.1689 -9.5127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4390 -8.2834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8863 -9.9146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6003 -9.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3169 -9.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0309 -9.4853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7483 -9.8873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4614 -9.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1789 -9.8694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8928 -9.4502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6136 -9.8557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3236 -9.4364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0444 -9.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7549 -9.4227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.4749 -9.8282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.1855 -9.4090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8678 -8.2715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5858 -8.6780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2968 -8.2595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0147 -8.6661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7257 -8.2476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4436 -8.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1546 -8.2357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8725 -8.6422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5835 -8.2237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3014 -8.6303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 43 1 0 0 0 0 22 2 1 1 0 0 0 25 2 1 6 0 0 0 3 22 1 0 0 0 0 3 26 1 0 0 0 0 21 4 1 1 0 0 0 28 4 1 6 0 0 0 5 29 1 0 0 0 0 5 31 1 0 0 0 0 6 28 1 0 0 0 0 6 35 1 0 0 0 0 23 7 1 1 0 0 0 24 8 1 6 0 0 0 31 9 1 1 0 0 0 9 39 1 0 0 0 0 27 10 1 1 0 0 0 30 11 1 6 0 0 0 32 12 1 6 0 0 0 33 13 1 1 0 0 0 34 14 1 1 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 41 18 1 1 0 0 0 19 43 2 0 0 0 0 40 20 1 6 0 0 0 20 43 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 22 24 1 0 0 0 0 23 24 1 0 0 0 0 25 27 1 0 0 0 0 25 29 1 0 0 0 0 26 36 1 1 0 0 0 27 30 1 0 0 0 0 28 32 1 0 0 0 0 29 37 1 1 0 0 0 30 31 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 38 1 1 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 44 2 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 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 54 55 1 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 58 1 1 0 0 0 0 59 58 1 0 0 0 0 60 59 1 0 0 0 0 61 60 1 0 0 0 0 62 61 1 0 0 0 0 63 62 1 0 0 0 0 64 63 1 0 0 0 0 65 64 1 0 0 0 0 66 65 1 0 0 0 0 67 66 1 0 0 0 0 M END > CHEM021654 > chemdb > CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCC > InChI=1S/C48H89NO18/c1-3-5-7-9-11-13-14-15-16-18-19-21-23-25-32(53)31(49-36(54)26-24-22-20-17-12-10-8-6-4-2)30-62-46-42(60)39(57)44(34(28-51)64-46)67-48-43(61)40(58)45(35(29-52)65-48)66-47-41(59)38(56)37(55)33(27-50)63-47/h23,25,31-35,37-48,50-53,55-61H,3-22,24,26-30H2,1-2H3,(H,49,54)/b25-23+/t31-,32+,33+,34+,35+,37-,38-,39+,40+,41+,42+,43+,44+,45-,46+,47+,48-/m0/s1 > HJVQASFQICDJJP-GJXDXCKOSA-N > C48H89NO18 > 968.2162 > 967.607965049 > 18 > 110.01869828291865 > 0 > 12 > 0 > 0 > N-[(2S,3R,4E)-1-{[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4R,5R,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-{[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-hydroxyoctadec-4-en-2-yl]dodecanamide > 3.17 > 3.7745735466666686 > -4.27 > 1 > 3 > 0 > 12.210380380602713 > 11.763938370753882 > -3.6483775752014047 > 307.00999999999993 > 244.61159999999995 > 35 > 0 > 5.23e-02 g/l > N-[(2S,3R,4E)-1-{[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4R,5R,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-{[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-hydroxyoctadec-4-en-2-yl]dodecanamide > 0 > Trihexosylceramide (d18:1/12:0) > 71965-57-6 > Trihexosylceramide (d18:1/16:0); Trihexosylceramide (d18:1/18:0); Trihexosylceramide (d18:1/20:0); Trihexosylceramide (d18:1/22:0); Trihexosylceramide (d18:1/24:0); Trihexosylceramide (d18:1/24:1(15Z)); Trihexosylceramide (d18:1/25:0); Trihexosylceramide (d18:1/26:1(17Z)); Trihexosylceramide (d18:1/9Z-18:1) $$$$