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2-dodecanoyl-sn-glycero-3-phosphoethanolamine

PropertiesImage
MNX_IDMNXM34808 Image of MNXM34808
referenceslm:000043349
formulaC17H36NO7P
global charge0
mol weight397.449
InChIKeyNPAZKTOOMVQLIH-MRXNPFEDSA-N
InChIInChI=1S/C17H36NO7P/c1-2-3-4-5-6-7-8-9-10-11-17(20)25-16(14-19)15-24-26(21,22)23-13-12-18/h16,19H,2-15,18H2,1H3,(H,21,22)/t16-/m1/s1
SMILESCCCCCCCCCCCC(=O)O[C@H](CO)COP(=O)([O-])OCC[NH3+]
MNX internals
InChI (mnx)InChI=1/C17H36NO7P/c1-2-3-4-5-6-7-8-9-10-11-17(20)25-16(14-19)15-24-26(21,22)23-13-12-18/h16,19H,2-15,18H2,1H3,(H,21,22)/t16-/m1/s1 Image of MNXM34808
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][C:17](=[O:20])[O:25][C@H:16]([CH2:14][OH:19])[CH2:15][O:24][P:26]([OH:21])(=[O:22])[O:23][CH2:13][CH2:12][NH2:18]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 6
Similar chemical compounds in external resources
IdentifierDescription

SLM:000043349
slm:000043349
NPAZKTOOMVQLIH-MRXNPFEDSA-N
2-dodecanoyl-sn-glycero-3-phosphoethanolamine
PE(0:0/12:0)

bigg.metabolite:2agpe120
biggM:2agpe120
vmhM:2agpe120
vmhmetabolite:2agpe120
NPAZKTOOMVQLIH-MRXNPFEDSA-N
2-Acyl-sn-glycero-3-phosphoethanolamine (n-C12:0)

metacyc.compound:CPD0-2178
metacycM:CPD0-2178
seed.compound:cpd26439
seedM:cpd26439
NPAZKTOOMVQLIH-MRXNPFEDSA-N
2-acyl-sn-glycero-3-phosphoethanolamine (n-C12:0)

biggM:M_2agpe120
seedM:M_cpd26439
vmhM:M_2agpe120
secondary/obsolete/fantasy identifier