1-(13Z,16Z-docosadienoyl)-2-(9Z,12Z,15Z,18Z-tetracosatetraenoyl)-sn-glycero-3-phosphoethanolamine

Properties Image MNX_ID MNXM220143 reference slm:000031495 formula C51H90NO8P global charge 0 mol weight 876.254 InChIKey OTYONSIERDMLPI-DVVMHCHISA-N InChI InChI=1S/C51H90NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-38-40-42-44-51(54)60-49(48-59-61(55,56)58-46-45-52)47-57-50(53)43-41-39-37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23-24,28,30,49H,3-10,15-16,21-22,25-27,29,31-48,52H2,1-2H3,(H,55,56)/b13-11-,14-12-,19-17-,20-18-,24-23-,30-28-/t49-/m1/s1 SMILES CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC)COP(=O)([O-])OCC[NH3+] MNX internals InChI (mnx) InChI=1/C51H90NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-38-40-42-44-51(54)60-49(48-59-61(55,56)58-46-45-52)47-57-50(53)43-41-39-37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23-24,28,30,49H,3-10,15-16,21-22,25-27,29,31-48,52H2,1-2H3,(H,55,56)/b13-11-,14-12-,19-17-,20-18-,24-23-,30-28-/t49-/m1/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:24]\[CH2:26]/[CH:28]=[CH:30]\[CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][C:51](=[O:54])[O:60][C@H:49]([CH2:47][O:57][C:50]([CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25][CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:53])[CH2:48][O:59][P:61]([OH:55])(=[O:56])[O:58][CH2:46][CH2:45][NH2:52]

Parent-child relations graph

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