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1-heptadecanoyl-2-(11Z,14Z,17Z,20Z,23Z-hexacosapentaenoyl)-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM360040 Image of MNXM360040
referenceslm:000013053
formulaC51H92NO8P
global charge0
mol weight878.27
InChIKeyHXAQDRKRVMYVHN-KBZHFLOTSA-N
InChIInChI=1S/C51H92NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-51(54)60-49(48-59-61(55,56)58-46-45-52(3,4)5)47-57-50(53)43-41-39-37-35-33-31-21-19-17-15-13-11-9-7-2/h8,10,14,16,20,22,24-25,27-28,49H,6-7,9,11-13,15,17-19,21,23,26,29-48H2,1-5H3/b10-8-,16-14-,22-20-,25-24-,28-27-/t49-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C51H92NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-51(54)60-49(48-59-61(55,56)58-46-45-52(3,4)5)47-57-50(53)43-41-39-37-35-33-31-21-19-17-15-13-11-9-7-2/h8,10,14,16,20,22,24-25,27-28,49H,6-7,9,11-13,15,17-19,21,23,26,29-48H2,1-5H3/b10-8-,16-14-,22-20-,25-24-,28-27-/t49-/m1/s1 Image of MNXM360040
SMILES (mnx)[CH3:1][CH2:6]/[CH:8]=[CH:10]\[CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26]/[CH:27]=[CH:28]\[CH2:29][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][CH2:21][CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:53])[CH2:48][O:59][P:61](=[O:55])([O-:56])[O:58][CH2:46][CH2:45][N+:52]([CH3:3])([CH3:4])[CH3:5]
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:000013053
slm:000013053
HXAQDRKRVMYVHN-KBZHFLOTSA-N
1-heptadecanoyl-2-(11Z,14Z,17Z,20Z,23Z-hexacosapentaenoyl)-sn-glycero-3-phosphocholine
PC(17:0/26:5(11Z,14Z,17Z,20Z,23Z))
Phosphatidylcholine (17:0/26:5(11Z,14Z,17Z,20Z,23Z))