1-(11Z,14Z,17Z,20Z,23Z-hexacosapentaenoyl)-2-(11Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine

Properties Image MNX_ID MNXM193315 reference slm:000030584 formula C49H86NO8P global charge 0 mol weight 848.2 InChIKey OZFZKRZZCAGXNV-LAHJBXNMSA-N InChI InChI=1S/C49H86NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-28-29-31-33-35-37-39-41-48(51)55-45-47(46-57-59(53,54)56-44-43-50)58-49(52)42-40-38-36-34-32-30-27-18-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-17,19,21-22,24-25,47H,3-4,6,8-10,12,15,18,20,23,26-46,50H2,1-2H3,(H,53,54)/b7-5-,13-11-,16-14-,19-17-,22-21-,25-24-/t47-/m1/s1 SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])OC(=O)CCCCCCCCC/C=C\CCCCCC MNX internals InChI (mnx) InChI=1/C49H86NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-28-29-31-33-35-37-39-41-48(51)55-45-47(46-57-59(53,54)56-44-43-50)58-49(52)42-40-38-36-34-32-30-27-18-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-17,19,21-22,24-25,47H,3-4,6,8-10,12,15,18,20,23,26-46,50H2,1-2H3,(H,53,54)/b7-5-,13-11-,16-14-,19-17-,22-21-,25-24-/t47-/m1/s1 SMILES (mnx) [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26][CH2:28][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][C:48](=[O:51])[O:55][CH2:45][C@H:47]([CH2:46][O:57][P:59]([OH:53])(=[O:54])[O:56][CH2:44][CH2:43][NH2:50])[O:58][C:49]([CH2:42][CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:27][CH2:18]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:52]

Parent-child relations graph

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