1,2-ditridecanoyl-3-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycerol

Properties Image MNX_ID MNXM109832 reference slm:000135251 formula C51H88O6 global charge 0 mol weight 797.259 InChIKey KRSDRGYBAZEYAI-ULWUBOGYSA-N InChI InChI=1S/C51H88O6/c1-4-7-10-13-16-19-22-23-24-25-26-27-28-29-30-33-35-38-41-44-50(53)56-47-48(57-51(54)45-42-39-36-32-21-18-15-12-9-6-3)46-55-49(52)43-40-37-34-31-20-17-14-11-8-5-2/h7,10,16,19,23-24,26-27,29-30,48H,4-6,8-9,11-15,17-18,20-22,25,28,31-47H2,1-3H3/b10-7-,19-16-,24-23-,27-26-,30-29-/t48-/m1/s1 SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCC)OC(=O)CCCCCCCCCCCC MNX internals InChI (mnx) InChI=1/C51H88O6/c1-4-7-10-13-16-19-22-23-24-25-26-27-28-29-30-33-35-38-41-44-50(53)56-47-48(57-51(54)45-42-39-36-32-21-18-15-12-9-6-3)46-55-49(52)43-40-37-34-31-20-17-14-11-8-5-2/h7,10,16,19,23-24,26-27,29-30,48H,4-6,8-9,11-15,17-18,20-22,25,28,31-47H2,1-3H3/b10-7-,19-16-,24-23-,27-26-,30-29-/t48-/m1/s1 SMILES (mnx) [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28]/[CH:29]=[CH:30]\[CH2:33][CH2:35][CH2:38][CH2:41][CH2:44][C:50](=[O:53])[O:56][CH2:47][C@@H:48]([CH2:46][O:55][C:49]([CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:52])[O:57][C:51]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:32][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:54]

Parent-child relations graph

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