1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-tetracosanoyl-sn-glycero-3-phosphocholine

Properties Image MNX_ID MNXM70640 reference slm:000010522 formula C54H96NO8P global charge 0 mol weight 918.335 InChIKey LKKWXROOWRVBLF-PQJGXWHOSA-N InChI InChI=1S/C54H96NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-27-29-31-33-35-37-39-41-43-45-47-54(57)63-52(51-62-64(58,59)61-49-48-55(3,4)5)50-60-53(56)46-44-42-40-38-36-34-32-30-28-25-23-21-19-17-15-13-11-9-7-2/h9,11,15,17,21,23,28,30,34,36,40,42,52H,6-8,10,12-14,16,18-20,22,24-27,29,31-33,35,37-39,41,43-51H2,1-5H3/b11-9-,17-15-,23-21-,30-28-,36-34-,42-40-/t52-/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](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCCCCCCCC MNX internals InChI (mnx) InChI=1/C54H96NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-27-29-31-33-35-37-39-41-43-45-47-54(57)63-52(51-62-64(58,59)61-49-48-55(3,4)5)50-60-53(56)46-44-42-40-38-36-34-32-30-28-25-23-21-19-17-15-13-11-9-7-2/h9,11,15,17,21,23,28,30,34,36,40,42,52H,6-8,10,12-14,16,18-20,22,24-27,29,31-33,35,37-39,41,43-51H2,1-5H3/b11-9-,17-15-,23-21-,30-28-,36-34-,42-40-/t52-/m1/s1 SMILES (mnx) [CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:20][CH2:22][CH2:24][CH2:26][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][C:54](=[O:57])[O:63][C@H:52]([CH2:50][O:60][C:53]([CH2:46][CH2:44]/[CH:42]=[CH:40]\[CH2:38]/[CH:36]=[CH:34]\[CH2:32]/[CH:30]=[CH:28]\[CH2:25]/[CH:23]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13]/[CH:11]=[CH:9]\[CH2:7][CH3:2])=[O:56])[CH2:51][O:62][P:64](=[O:58])([O-:59])[O:61][CH2:49][CH2:48][N+:55]([CH3:3])([CH3:4])[CH3:5]

Parent-child relations graph

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