1-dodecanoyl-2-(7Z,10Z,13Z,16Z-docosatetraenoyl)-sn-glycero-3-phosphoethanolamine

Properties Image MNX_ID MNXM71205 reference slm:000035282 formula C39H70NO8P global charge 0 mol weight 711.962 InChIKey NMEDKQOSUIBTAE-AWZIVJJRSA-N InChI InChI=1S/C39H70NO8P/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40)35-45-38(41)31-29-27-25-23-12-10-8-6-4-2/h11,13,15-16,18-19,21-22,37H,3-10,12,14,17,20,23-36,40H2,1-2H3,(H,43,44)/b13-11-,16-15-,19-18-,22-21-/t37-/m1/s1 SMILES CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC)COP(=O)([O-])OCC[NH3+] MNX internals InChI (mnx) InChI=1/C39H70NO8P/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40)35-45-38(41)31-29-27-25-23-12-10-8-6-4-2/h11,13,15-16,18-19,21-22,37H,3-10,12,14,17,20,23-36,40H2,1-2H3,(H,43,44)/b13-11-,16-15-,19-18-,22-21-/t37-/m1/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:14]/[CH:15]=[CH:16]\[CH2:17]/[CH:18]=[CH:19]\[CH2:20]/[CH:21]=[CH:22]\[CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][C:39](=[O:42])[O:48][C@H:37]([CH2:35][O:45][C:38]([CH2:31][CH2:29][CH2:27][CH2:25][CH2:23][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:41])[CH2:36][O:47][P:49]([OH:43])(=[O:44])[O:46][CH2:34][CH2:33][NH2:40]

Parent-child relations graph

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