1-docosanoyl-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-3-hexadecanoyl-sn-glycerol

Properties Image MNX_ID MNXM134222 reference slm:000233555 formula C63H112O6 global charge 0 mol weight 965.583 InChIKey ZWDRUMGFLNADOE-NTONVAHKSA-N InChI InChI=1S/C63H112O6/c1-4-7-10-13-16-19-22-25-27-29-31-33-35-38-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-40-37-24-21-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-39-36-34-32-30-28-26-23-20-17-14-11-8-5-2/h17,20,26,28,32,34,39,42,48,51,60H,4-16,18-19,21-25,27,29-31,33,35-38,40-41,43-47,49-50,52-59H2,1-3H3/b20-17-,28-26-,34-32-,42-39-,51-48-/t60-/m0/s1 SMILES CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCC MNX internals InChI (mnx) InChI=1/C63H112O6/c1-4-7-10-13-16-19-22-25-27-29-31-33-35-38-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-40-37-24-21-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-39-36-34-32-30-28-26-23-20-17-14-11-8-5-2/h17,20,26,28,32,34,39,42,48,51,60H,4-16,18-19,21-25,27,29-31,33,35-38,40-41,43-47,49-50,52-59H2,1-3H3/b20-17-,28-26-,34-32-,42-39-,51-48-/t60-/m0/s1 SMILES (mnx) [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][C:62](=[O:65])[O:68][CH2:59][C@H:60]([CH2:58][O:67][C:61]([CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:64])[O:69][C:63]([CH2:57][CH2:54]/[CH:51]=[CH:48]\[CH2:45]/[CH:42]=[CH:39]\[CH2:36]/[CH:34]=[CH:32]\[CH2:30]/[CH:28]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:66]

Parent-child relations graph

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