1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-tetradecanoyl-3-(13Z-docosenoyl)-sn-glycerol

Properties Image MNX_ID MNXM142128 reference slm:000209535 formula C61H104O6 global charge 0 mol weight 933.497 InChIKey MVRWFTFQHAVMSJ-KHBPMPQLSA-N InChI InChI=1S/C61H104O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-34-36-39-41-44-47-50-53-59(62)65-56-58(67-61(64)55-52-49-46-43-38-21-18-15-12-9-6-3)57-66-60(63)54-51-48-45-42-40-37-35-33-31-29-27-25-23-20-17-14-11-8-5-2/h7,10,16,19,24-27,30,32,36,39,44,47,58H,4-6,8-9,11-15,17-18,20-23,28-29,31,33-35,37-38,40-43,45-46,48-57H2,1-3H3/b10-7-,19-16-,26-24-,27-25-,32-30-,39-36-,47-44-/t58-/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)CCCCCCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCCCCCC MNX internals InChI (mnx) InChI=1/C61H104O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-34-36-39-41-44-47-50-53-59(62)65-56-58(67-61(64)55-52-49-46-43-38-21-18-15-12-9-6-3)57-66-60(63)54-51-48-45-42-40-37-35-33-31-29-27-25-23-20-17-14-11-8-5-2/h7,10,16,19,24-27,30,32,36,39,44,47,58H,4-6,8-9,11-15,17-18,20-23,28-29,31,33-35,37-38,40-43,45-46,48-57H2,1-3H3/b10-7-,19-16-,26-24-,27-25-,32-30-,39-36-,47-44-/t58-/m1/s1 SMILES (mnx) [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:28]/[CH:30]=[CH:32]\[CH2:34]/[CH:36]=[CH:39]\[CH2:41]/[CH:44]=[CH:47]\[CH2:50][CH2:53][C:59](=[O:62])[O:65][CH2:56][C@H:58]([CH2:57][O:66][C:60]([CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:40][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29]/[CH:27]=[CH:25]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:63])[O:67][C:61]([CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:38][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:64]

Parent-child relations graph

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