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

Properties Image MNX_ID MNXM317170 reference slm:000034341 formula C45H78NO8P global charge 0 mol weight 792.092 InChIKey SXOHHRKTLDHVMJ-OJXBVIQLSA-N InChI InChI=1S/C45H78NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-27-29-31-33-35-37-44(47)51-41-43(42-53-55(49,50)52-40-39-46)54-45(48)38-36-34-32-30-28-25-16-14-12-10-8-6-4-2/h8,10-11,13-14,16-18,20-21,23-24,43H,3-7,9,12,15,19,22,25-42,46H2,1-2H3,(H,49,50)/b10-8-,13-11-,16-14-,18-17-,21-20-,24-23-/t43-/m1/s1 SMILES CCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCC[NH3+] MNX internals InChI (mnx) InChI=1/C45H78NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-27-29-31-33-35-37-44(47)51-41-43(42-53-55(49,50)52-40-39-46)54-45(48)38-36-34-32-30-28-25-16-14-12-10-8-6-4-2/h8,10-11,13-14,16-18,20-21,23-24,43H,3-7,9,12,15,19,22,25-42,46H2,1-2H3,(H,49,50)/b10-8-,13-11-,16-14-,18-17-,21-20-,24-23-/t43-/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]\[CH2:26][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][C:44](=[O:47])[O:51][CH2:41][C@H:43]([CH2:42][O:53][P:55]([OH:49])(=[O:50])[O:52][CH2:40][CH2:39][NH2:46])[O:54][C:45]([CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:25]/[CH:16]=[CH:14]\[CH2:12]/[CH:10]=[CH:8]\[CH2:6][CH2:4][CH3:2])=[O:48]

Parent-child relations graph

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