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1-docosanoyl-2-(13-methyltetradecanoyl)-sn-glycero-3-phosphoethanolamine

PropertiesImage
MNX_IDMNXM346504 Image of MNXM346504
referenceslm:000035171
formulaC42H84NO8P
global charge0
mol weight762.107
InChIKeyRZKWJMYSQMKEFL-RRHRGVEJSA-N
InChIInChI=1S/C42H84NO8P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24-27-30-33-41(44)48-37-40(38-50-52(46,47)49-36-35-43)51-42(45)34-31-28-25-22-19-20-23-26-29-32-39(2)3/h39-40H,4-38,43H2,1-3H3,(H,46,47)/t40-/m1/s1
SMILESCCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])OC(=O)CCCCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C42H84NO8P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24-27-30-33-41(44)48-37-40(38-50-52(46,47)49-36-35-43)51-42(45)34-31-28-25-22-19-20-23-26-29-32-39(2)3/h39-40H,4-38,43H2,1-3H3,(H,46,47)/t40-/m1/s1 Image of MNXM346504
SMILES (mnx)[CH3:1][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:21][CH2:24][CH2:27][CH2:30][CH2:33][C:41](=[O:44])[O:48][CH2:37][C@H:40]([CH2:38][O:50][P:52]([OH:46])(=[O:47])[O:49][CH2:36][CH2:35][NH2:43])[O:51][C:42]([CH2:34][CH2:31][CH2:28][CH2:25][CH2:22][CH2:19][CH2:20][CH2:23][CH2:26][CH2:29][CH2:32][CH:39]([CH3:2])[CH3:3])=[O:45]
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:000035171
slm:000035171
RZKWJMYSQMKEFL-RRHRGVEJSA-N
1-docosanoyl-2-(13-methyltetradecanoyl)-sn-glycero-3-phosphoethanolamine
PE(22:0/15:0)
Phosphatidylethanolamine (22:0/15:0)