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1-(15Z,18Z,21Z,24Z-triacontatetraenoyl)-2-heneicosanoyl-sn-glycero-3-phosphoethanolamine

PropertiesImage
MNX_IDMNXM233229 Image of MNXM233229
referenceslm:000031903
formulaC56H104NO8P
global charge0
mol weight950.421
InChIKeyYQEWECSULXDBIQ-QMQGSCHNSA-N
InChIInChI=1S/C56H104NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-33-34-36-38-40-42-44-46-48-55(58)62-52-54(53-64-66(60,61)63-51-50-57)65-56(59)49-47-45-43-41-39-37-35-32-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,23-24,26-27,54H,3-10,12,14-16,18,20-22,25,28-53,57H2,1-2H3,(H,60,61)/b13-11-,19-17-,24-23-,27-26-/t54-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])OC(=O)CCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C56H104NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-33-34-36-38-40-42-44-46-48-55(58)62-52-54(53-64-66(60,61)63-51-50-57)65-56(59)49-47-45-43-41-39-37-35-32-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,23-24,26-27,54H,3-10,12,14-16,18,20-22,25,28-53,57H2,1-2H3,(H,60,61)/b13-11-,19-17-,24-23-,27-26-/t54-/m1/s1 Image of MNXM233229
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]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28][CH2:29][CH2:30][CH2:31][CH2:33][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][C:55](=[O:58])[O:62][CH2:52][C@H:54]([CH2:53][O:64][P:66]([OH:60])(=[O:61])[O:63][CH2:51][CH2:50][NH2:57])[O:65][C:56]([CH2:49][CH2:47][CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:32][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:59]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

SLM:000031903
slm:000031903
YQEWECSULXDBIQ-QMQGSCHNSA-N
1-(15Z,18Z,21Z,24Z-triacontatetraenoyl)-2-heneicosanoyl-sn-glycero-3-phosphoethanolamine
PE(30:4(15Z,18Z,21Z,24Z)/21:0)
Phosphatidylethanolamine (30:4(15Z,18Z,21Z,24Z)/21:0)