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1-acetyl-2-(10Z,13Z,16Z-docosatrienoyl)-sn-glycero-3-phosphoethanolamine

PropertiesImage
MNX_IDMNXM342149 Image of MNXM342149
referenceslm:000034923
formulaC29H52NO8P
global charge0
mol weight573.708
InChIKeyQUSBHEAKUFNIGT-NXVQAEBMSA-N
InChIInChI=1S/C29H52NO8P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-29(32)38-28(25-35-27(2)31)26-37-39(33,34)36-24-23-30/h7-8,10-11,13-14,28H,3-6,9,12,15-26,30H2,1-2H3,(H,33,34)/b8-7-,11-10-,14-13-/t28-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)O[C@H](COC(C)=O)COP(=O)([O-])OCC[NH3+]
MNX internals
InChI (mnx)InChI=1/C29H52NO8P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-29(32)38-28(25-35-27(2)31)26-37-39(33,34)36-24-23-30/h7-8,10-11,13-14,28H,3-6,9,12,15-26,30H2,1-2H3,(H,33,34)/b8-7-,11-10-,14-13-/t28-/m1/s1 Image of MNXM342149
SMILES (mnx)[CH3:1][CH2:3][CH2:4][CH2:5][CH2:6]/[CH:7]=[CH:8]\[CH2:9]/[CH:10]=[CH:11]\[CH2:12]/[CH:13]=[CH:14]\[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][C:29](=[O:32])[O:38][C@H:28]([CH2:25][O:35][C:27]([CH3:2])=[O:31])[CH2:26][O:37][P:39]([OH:33])(=[O:34])[O:36][CH2:24][CH2:23][NH2:30]
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:000034923
slm:000034923
QUSBHEAKUFNIGT-NXVQAEBMSA-N
1-acetyl-2-(10Z,13Z,16Z-docosatrienoyl)-sn-glycero-3-phosphoethanolamine
PE(2:0/22:3(10Z,13Z,16Z))
Phosphatidylethanolamine (2:0/22:3(10Z,13Z,16Z))