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PC(22:0/20:2(11Z,14Z))

PropertiesImage
MNX_IDMNXM70362 Image of MNXM70362
referencechebi:89070
formulaC50H96NO8P
global charge0
mol weight870.291
InChIKeyLFYYYSNBZJRBSA-HHITYQTISA-N
InChIInChI=1S/C50H96NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-27-28-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51(3,4)5)59-50(53)43-41-39-37-35-33-31-29-26-23-21-19-17-15-13-11-9-7-2/h15,17,21,23,48H,6-14,16,18-20,22,24-47H2,1-5H3/b17-15-,23-21-/t48-/m1/s1
SMILESCCCCC/C=C\C/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C50H96NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-27-28-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51(3,4)5)59-50(53)43-41-39-37-35-33-31-29-26-23-21-19-17-15-13-11-9-7-2/h15,17,21,23,48H,6-14,16,18-20,22,24-47H2,1-5H3/b17-15-,23-21-/t48-/m1/s1 Image of MNXM70362
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][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][C:49](=[O:52])[O:56][CH2:46][C@H:48]([CH2:47][O:58][P:60](=[O:54])([O-:55])[O:57][CH2:45][CH2:44][N+:51]([CH3:3])([CH3:4])[CH3:5])[O:59][C:50]([CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:26]/[CH:23]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:53]
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:89070
chebi:89070
LFYYYSNBZJRBSA-HHITYQTISA-N 		PC(22:0/20:2(11Z,14Z))
(2-{[(2R)-3-(docosanoyloxy)-2-[(11Z,14Z)-icosa-11,14-dienoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium
1-Behenoyl-2-eicosadienoyl-sn-glycero-3-phosphocholine
GPCho(22:0/20:2)
GPCho(22:0/20:2n6)
GPCho(22:0/20:2w6)
GPCho(42:2)
Lecithin
PC aa C42:2
PC(22:0/20:2)
PC(22:0/20:2n6)
PC(22:0/20:2w6)
PC(42:2)
Phosphatidylcholine(22:0/20:2)
Phosphatidylcholine(22:0/20:2n6)
Phosphatidylcholine(22:0/20:2w6)
Phosphatidylcholine(42:2)

SLM:000012742
slm:000012742
LFYYYSNBZJRBSA-HHITYQTISA-N 		1-docosanoyl-2-(11Z,14Z-eicosadienoyl)-sn-glycero-3-phosphocholine
PC(22:0/20:2(11Z,14Z))
Phosphatidylcholine (22:0/20:2(11Z,14Z))
hmdb:HMDB0008539
LFYYYSNBZJRBSA-HHITYQTISA-N 		PC(22:0/20:2(11Z,14Z))
(2-{[(2R)-3-(docosanoyloxy)-2-[(11Z,14Z)-icosa-11,14-dienoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium
1-behenoyl-2-eicosadienoyl-sn-glycero-3-phosphocholine
1-docosanoyl-2-(11Z,14Z-eicosadienoyl)-sn-glycero-3-phosphocholine
GPCho(22:0/20:2)
GPCho(42:2)
Lecithin
PC Aa C42:2
PC(22:0/20:2)
PC(22:0/20:2W6)
PC(22:0/20:2n6)
PC(42:2)
Phosphatidylcholine(22:0/20:2)
Phosphatidylcholine(22:0/20:2W6)
Phosphatidylcholine(22:0/20:2n6)
Phosphatidylcholine(42:2)
gpcho(22:0/20:2W6)
gpcho(22:0/20:2n6)
lecithin

lipidmaps:LMGP01011995
lipidmapsM:LMGP01011995
LFYYYSNBZJRBSA-HHITYQTISA-N 		PC(22:0/20:2(11Z,14Z))
1-docosanoyl-2-(11Z,14Z-eicosadienoyl)-glycero-3-phosphocholine
PC 42:2
PC(20:2_22:0)
PC(42:2)

hmdb:HMDB08539 		secondary/obsolete/fantasy identifier