1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-(9Z,12Z-octadecadienoyl)-3-(15Z-tetracosenoyl)-sn-glycerol

Properties Image MNX_ID MNXM144413 reference slm:000264026 formula C67H112O6 global charge 0 mol weight 1013.627 InChIKey VFSASFDKKPCACM-TWZXCRRRSA-N InChI InChI=1S/C67H112O6/c1-4-7-10-13-16-19-22-25-28-30-32-33-35-37-40-42-45-48-51-54-57-60-66(69)72-63-64(73-67(70)61-58-55-52-49-46-43-38-27-24-21-18-15-12-9-6-3)62-71-65(68)59-56-53-50-47-44-41-39-36-34-31-29-26-23-20-17-14-11-8-5-2/h8,11,17-18,20-21,25-29,34,36,38,41,44,50,53,64H,4-7,9-10,12-16,19,22-24,30-33,35,37,39-40,42-43,45-49,51-52,54-63H2,1-3H3/b11-8-,20-17-,21-18-,28-25-,29-26-,36-34-,38-27-,44-41-,53-50-/t64-/m1/s1 SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC MNX internals InChI (mnx) InChI=1/C67H112O6/c1-4-7-10-13-16-19-22-25-28-30-32-33-35-37-40-42-45-48-51-54-57-60-66(69)72-63-64(73-67(70)61-58-55-52-49-46-43-38-27-24-21-18-15-12-9-6-3)62-71-65(68)59-56-53-50-47-44-41-39-36-34-31-29-26-23-20-17-14-11-8-5-2/h8,11,17-18,20-21,25-29,34,36,38,41,44,50,53,64H,4-7,9-10,12-16,19,22-24,30-33,35,37,39-40,42-43,45-49,51-52,54-63H2,1-3H3/b11-8-,20-17-,21-18-,28-25-,29-26-,36-34-,38-27-,44-41-,53-50-/t64-/m1/s1 SMILES (mnx) [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22]/[CH:25]=[CH:28]\[CH2:30][CH2:32][CH2:33][CH2:35][CH2:37][CH2:40][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][C:66](=[O:69])[O:72][CH2:63][C@@H:64]([CH2:62][O:71][C:65]([CH2:59][CH2:56]/[CH:53]=[CH:50]\[CH2:47]/[CH:44]=[CH:41]\[CH2:39]/[CH:36]=[CH:34]\[CH2:31]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:68])[O:73][C:67]([CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43]/[CH:38]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:70]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0