1-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-2-(11Z-octadecenoyl)-3-hexadecanoyl-sn-glycerol

Properties Image MNX_ID MNXM133732 reference slm:000170511 formula C57H98O6 global charge 0 mol weight 879.405 InChIKey BICSRRMOKQNZTH-TWAYUJNESA-N InChI InChI=1S/C57H98O6/c1-4-7-10-13-16-19-22-25-27-28-30-32-35-38-41-44-47-50-56(59)62-53-54(52-61-55(58)49-46-43-40-37-34-31-24-21-18-15-12-9-6-3)63-57(60)51-48-45-42-39-36-33-29-26-23-20-17-14-11-8-5-2/h7,10,16,19-20,23,25,27,30,32,38,41,54H,4-6,8-9,11-15,17-18,21-22,24,26,28-29,31,33-37,39-40,42-53H2,1-3H3/b10-7-,19-16-,23-20-,27-25-,32-30-,41-38-/t54-/m0/s1 SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCC/C=C\CCCCCC MNX internals InChI (mnx) InChI=1/C57H98O6/c1-4-7-10-13-16-19-22-25-27-28-30-32-35-38-41-44-47-50-56(59)62-53-54(52-61-55(58)49-46-43-40-37-34-31-24-21-18-15-12-9-6-3)63-57(60)51-48-45-42-39-36-33-29-26-23-20-17-14-11-8-5-2/h7,10,16,19-20,23,25,27,30,32,38,41,54H,4-6,8-9,11-15,17-18,21-22,24,26,28-29,31,33-37,39-40,42-53H2,1-3H3/b10-7-,19-16-,23-20-,27-25-,32-30-,41-38-/t54-/m0/s1 SMILES (mnx) [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:27]\[CH2:28]/[CH:30]=[CH:32]\[CH2:35]/[CH:38]=[CH:41]\[CH2:44][CH2:47][CH2:50][C:56](=[O:59])[O:62][CH2:53][C@H:54]([CH2:52][O:61][C:55]([CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:58])[O:63][C:57]([CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:29][CH2:26]/[CH:23]=[CH:20]\[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:60]

Parent-child relations graph

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