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1-eicosanoyl-2-docosanoyl-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM69992 Image of MNXM69992
referencechebi:86211
formulaC50H100NO8P
global charge0
mol weight874.323
InChIKeyUTWUFCVPUHKIOD-QSCHNALKSA-N
InChIInChI=1S/C50H100NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-27-29-31-33-35-37-39-41-43-50(53)59-48(47-58-60(54,55)57-45-44-51(3,4)5)46-56-49(52)42-40-38-36-34-32-30-28-26-23-21-19-17-15-13-11-9-7-2/h48H,6-47H2,1-5H3/t48-/m1/s1
SMILESCCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C50H100NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-27-29-31-33-35-37-39-41-43-50(53)59-48(47-58-60(54,55)57-45-44-51(3,4)5)46-56-49(52)42-40-38-36-34-32-30-28-26-23-21-19-17-15-13-11-9-7-2/h48H,6-47H2,1-5H3/t48-/m1/s1 Image of MNXM69992
SMILES (mnx)[CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:20][CH2:22][CH2:24][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][C:50](=[O:53])[O:59][C@H:48]([CH2:46][O:56][C:49]([CH2:42][CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:23][CH2:21][CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:52])[CH2:47][O:58][P:60](=[O:54])([O-:55])[O:57][CH2:45][CH2:44][N+:51]([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

CHEBI:86211
chebi:86211
UTWUFCVPUHKIOD-QSCHNALKSA-N 		1-eicosanoyl-2-docosanoyl-sn-glycero-3-phosphocholine
(2R)-2-(docosanoyloxy)-3-(icosanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
1-Arachidonyl-2-behenoyl-sn-glycero-3-phosphocholine
GPCho(20:0/22:0)
PC(20:0/22:0)
Phosphatidylcholine(20:0/22:0)

SLM:000012953
slm:000012953
UTWUFCVPUHKIOD-QSCHNALKSA-N 		1-eicosanoyl-2-docosanoyl-sn-glycero-3-phosphocholine
PC(20:0/22:0)
Phosphatidylcholine (20:0/22:0)
hmdb:HMDB0008282
UTWUFCVPUHKIOD-QSCHNALKSA-N 		PC(20:0/22:0)
(2-{[(2R)-2-(docosanoyloxy)-3-(icosanoyloxy)propyl phosphono]oxy}ethyl)trimethylazanium
1-Arachidonyl-2-behenoyl-sn-glycero-3-phosphocholine
1-Eicosanoyl-2-docosanoyl-sn-glycero-3-phosphocholine
GPCho(20:0/22:0)
GPCho(42:0)
Lecithin
PC(42:0)
Phosphatidylcholine(20:0/22:0)
Phosphatidylcholine(42:0)

lipidmaps:LMGP01011025
lipidmapsM:LMGP01011025
UTWUFCVPUHKIOD-QSCHNALKSA-N 		PC(20:0/22:0)
1-eicosanoyl-2-docosanoyl-sn-glycero-3-phosphocholine
PC 42:0
PC(20:0_22:0)
PC(42:0)

hmdb:HMDB08282 		secondary/obsolete/fantasy identifier