1-(12Z,15Z,18Z,21Z,24Z-triacontapentaenoyl)-2-(6Z-hexadecenoyl)-sn-glycero-3-phosphoethanolamine

Properties Image MNX_ID MNXM211469 reference slm:000031169 formula C51H90NO8P global charge 0 mol weight 876.254 InChIKey BBAOYVBSGZUMPP-HVJSVAFJSA-N InChI InChI=1S/C51H90NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-28-29-30-32-33-35-37-39-41-43-50(53)57-47-49(48-59-61(55,56)58-46-45-52)60-51(54)44-42-40-38-36-34-31-16-14-12-10-8-6-4-2/h11,13,17-18,20-21,23-24,26-27,34,36,49H,3-10,12,14-16,19,22,25,28-33,35,37-48,52H2,1-2H3,(H,55,56)/b13-11-,18-17-,21-20-,24-23-,27-26-,36-34-/t49-/m1/s1 SMILES CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])OC(=O)CCCC/C=C\CCCCCCCCC MNX internals InChI (mnx) InChI=1/C51H90NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-28-29-30-32-33-35-37-39-41-43-50(53)57-47-49(48-59-61(55,56)58-46-45-52)60-51(54)44-42-40-38-36-34-31-16-14-12-10-8-6-4-2/h11,13,17-18,20-21,23-24,26-27,34,36,49H,3-10,12,14-16,19,22,25,28-33,35,37-48,52H2,1-2H3,(H,55,56)/b13-11-,18-17-,21-20-,24-23-,27-26-,36-34-/t49-/m1/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28][CH2:29][CH2:30][CH2:32][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][C:50](=[O:53])[O:57][CH2:47][C@H:49]([CH2:48][O:59][P:61]([OH:55])(=[O:56])[O:58][CH2:46][CH2:45][NH2:52])[O:60][C:51]([CH2:44][CH2:42][CH2:40][CH2:38]/[CH:36]=[CH:34]\[CH2:31][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:54]

Parent-child relations graph

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