Ketcher 11301712202D 1 1.00000 0.00000 0 65 66 0 1 0 999 V2000 7.6779 -73.2699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6779 -74.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8183 -72.7735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8183 -74.7590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9586 -73.2699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9586 -74.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5378 -72.7735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5378 -74.7590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8183 -75.7517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0988 -74.7590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0988 -72.7735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2391 -73.2699 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4032 -73.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2572 -72.7534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1227 -73.2398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9765 -72.7334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8420 -73.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6959 -72.7133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5613 -73.1995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4153 -72.6932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2807 -73.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1347 -72.6732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0002 -73.1595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8539 -72.6531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7195 -73.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5734 -72.6331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4388 -73.1194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2929 -72.6130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1583 -73.0994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.0121 -72.5930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2456 -71.2823 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1013 -70.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9594 -71.2786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8208 -70.7854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6789 -71.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5403 -70.7913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3984 -71.2908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2598 -70.7975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0993 -69.7865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1343 -74.2324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9650 -71.7406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1178 -71.2969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9792 -70.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8373 -71.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6988 -70.8096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5567 -71.3090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4183 -70.8157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2762 -71.3151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1377 -70.8217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9957 -71.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.8531 -70.8207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.8485 -69.8280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9864 -69.3357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1290 -69.8361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2670 -69.3437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4095 -69.8441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5475 -69.3518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6901 -69.8521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8280 -69.3598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8234 -68.3670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9613 -67.8747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6809 -67.8666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9568 -66.8818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6762 -66.8739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8142 -66.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 2 4 1 0 0 0 3 5 1 0 0 0 4 6 1 0 0 0 5 6 1 0 0 0 1 7 1 6 0 0 2 8 1 6 0 0 4 9 1 1 0 0 6 10 1 1 0 0 5 11 1 1 0 0 12 11 1 0 0 0 13 7 1 0 0 0 14 13 1 0 0 0 15 14 1 0 0 0 16 15 1 0 0 0 17 16 1 0 0 0 18 17 1 0 0 0 19 18 1 0 0 0 20 19 1 0 0 0 21 20 1 0 0 0 22 21 1 0 0 0 23 22 1 0 0 0 24 23 1 0 0 0 25 24 1 0 0 0 26 25 1 0 0 0 27 26 1 0 0 0 28 27 1 0 0 0 29 28 1 0 0 0 30 29 1 0 0 0 14 31 1 6 0 0 31 32 1 0 0 0 33 32 1 0 0 0 34 33 1 0 0 0 35 34 1 0 0 0 36 35 1 0 0 0 37 36 1 0 0 0 38 37 1 0 0 0 32 39 2 0 0 0 15 40 1 1 0 0 16 41 1 6 0 0 38 42 1 0 0 0 42 43 1 0 0 0 43 44 1 0 0 0 44 45 1 0 0 0 45 46 1 0 0 0 46 47 1 0 0 0 47 48 1 0 0 0 48 49 1 0 0 0 49 50 1 0 0 0 50 51 1 0 0 0 51 52 1 0 0 0 52 53 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 55 56 1 0 0 0 56 57 1 0 0 0 57 58 1 0 0 0 58 59 1 0 0 0 61 60 1 0 0 0 62 60 2 0 0 0 63 61 2 0 0 0 64 62 1 0 0 0 65 63 1 0 0 0 65 64 2 0 0 0 59 60 1 0 0 0 M END > CHEBI:139170 > 1-O-(alpha-D-galactopyranosyl)-N-(25-phenylpentacosanoyl)phytosphingosine > A glycophytoceramide having an α-D-galactopyranosyl residue at the O-1 position and a 25-phenylpentacosanoyl group attached to the nitrogen. > 3 > N-{(1S,2S,3R)-1-[(alpha-D-galactopyranosyloxy)methyl]- 2,3-dihydroxyheptadecyl}-25-phenylpentacosanamide > N-[(2S,3S,4R)-1-(alpha-D-galactopyranosyloxy)-3,4-dihydroxyoctadecan-2-yl]-25-phenylpentacosanamide > C55H101NO9 > 920.394 > 919.74763 > 0 > [C@H]1([C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)OC[C@@H]([C@@H]([C@@H](CCCCCCCCCCCCCC)O)O)NC(CCCCCCCCCCCCCCCCCCCCCCCCC=2C=CC=CC2)=O > InChI=1S/C55H101NO9/c1-2-3-4-5-6-7-8-22-25-28-31-37-42-48(58)51(60)47(45-64-55-54(63)53(62)52(61)49(44-57)65-55)56-50(59)43-38-32-29-26-23-20-18-16-14-12-10-9-11-13-15-17-19-21-24-27-30-34-39-46-40-35-33-36-41-46/h33,35-36,40-41,47-49,51-55,57-58,60-63H,2-32,34,37-39,42-45H2,1H3,(H,56,59)/t47-,48+,49+,51-,52-,53-,54+,55-/m0/s1 > RAHAOVBEMXCOLX-VEDNRHISSA-N > 18641324 > 20616071 $$$$