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1-(11E-octadecenoyl)-2-octacosanoyl-sn-glycero-3-phosphoethanolamine

PropertiesImage
MNX_IDMNXM192703 Image of MNXM192703
referenceslm:000030487
formulaC51H100NO8P
global charge0
mol weight886.334
InChIKeyZZUKLYBALYMXFA-RTJIUGGDSA-N
InChIInChI=1S/C51H100NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-44-51(54)60-49(48-59-61(55,56)58-46-45-52)47-57-50(53)43-41-39-37-35-33-31-29-18-16-14-12-10-8-6-4-2/h14,16,49H,3-13,15,17-48,52H2,1-2H3,(H,55,56)/b16-14+/t49-/m1/s1
SMILESCCCCCC/C=C/CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C51H100NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-44-51(54)60-49(48-59-61(55,56)58-46-45-52)47-57-50(53)43-41-39-37-35-33-31-29-18-16-14-12-10-8-6-4-2/h14,16,49H,3-13,15,17-48,52H2,1-2H3,(H,55,56)/b16-14+/t49-/m1/s1 Image of MNXM192703
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][C:51](=[O:54])[O:60][C@H:49]([CH2:47][O:57][C:50]([CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:18]/[CH:16]=[CH:14]/[CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:53])[CH2:48][O:59][P:61]([OH:55])(=[O:56])[O:58][CH2:46][CH2:45][NH2:52]
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:000030487
slm:000030487
ZZUKLYBALYMXFA-RTJIUGGDSA-N
1-(11E-octadecenoyl)-2-octacosanoyl-sn-glycero-3-phosphoethanolamine
PE(18:1(11E)/28:0)
Phosphatidylethanolamine (18:1(11E)/28:0)