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PC(o-22:0/18:3(6Z,9Z,12Z))

PropertiesImage
MNX_IDMNXM70961 Image of MNXM70961
referencechebi:89854
formulaC48H92NO7P
global charge0
mol weight826.238
InChIKeyWEFAHDSLMVUAHQ-GEVWEYGMSA-N
InChIInChI=1S/C48H92NO7P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-28-30-32-34-36-38-40-43-53-45-47(46-55-57(51,52)54-44-42-49(3,4)5)56-48(50)41-39-37-35-33-31-29-27-21-19-17-15-13-11-9-7-2/h15,17,21,27,31,33,47H,6-14,16,18-20,22-26,28-30,32,34-46H2,1-5H3/b17-15-,27-21-,33-31-/t47-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C48H92NO7P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-28-30-32-34-36-38-40-43-53-45-47(46-55-57(51,52)54-44-42-49(3,4)5)56-48(50)41-39-37-35-33-31-29-27-21-19-17-15-13-11-9-7-2/h15,17,21,27,31,33,47H,6-14,16,18-20,22-26,28-30,32,34-46H2,1-5H3/b17-15-,27-21-,33-31-/t47-/m1/s1 Image of MNXM70961
SMILES (mnx)[CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:20][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:43][O:53][CH2:45][C@H:47]([CH2:46][O:55][P:57](=[O:51])([O-:52])[O:54][CH2:44][CH2:42][N+:49]([CH3:3])([CH3:4])[CH3:5])[O:56][C:48]([CH2:41][CH2:39][CH2:37][CH2:35]/[CH:33]=[CH:31]\[CH2:29]/[CH:27]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:50]
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:89854
chebi:89854
WEFAHDSLMVUAHQ-GEVWEYGMSA-N 		PC(o-22:0/18:3(6Z,9Z,12Z))
(2-{[(2R)-3-(docosyloxy)-2-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium
1-Behenyl-2-g-linolenoyl-sn-glycero-3-phosphocholine
1-Behenyl-2-gamma-linolenoyl-sn-glycero-3-phosphocholine
GPCho(22:0/18:3)
GPCho(22:0/18:3n6)
GPCho(22:0/18:3w6)
GPCho(40:3)
Lecithin
PC ae C40:3
PC(22:0/18:3)
PC(22:0/18:3n6)
PC(22:0/18:3w6)
PC(40:3)
PC(O-40:3)
Phosphatidylcholine(22:0/18:3)
Phosphatidylcholine(22:0/18:3n6)
Phosphatidylcholine(22:0/18:3w6)
Phosphatidylcholine(40:3)

SLM:000027907
slm:000027907
WEFAHDSLMVUAHQ-GEVWEYGMSA-N 		1-O-docosyl-2-(6Z,9Z,12Z-octadecatrienoyl)-sn-glycero-3-phosphocholine
1-docosyl-2-(6Z,9Z,12Z-octadecatrienoyl)-sn-glycero-3-phosphocholine
PC(O-22:0/18:3(6Z,9Z,12Z))
Phosphatidylcholine (O-22:0/18:3(6Z,9Z,12Z))
hmdb:HMDB0013445
WEFAHDSLMVUAHQ-GEVWEYGMSA-N 		PC(O-22:0/18:3(6Z,9Z,12Z))
(2-{[(2R)-3-(docosyloxy)-2-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium
1-Behenyl-2-g-linolenoyl-sn-glycero-3-phosphocholine
1-Behenyl-2-gamma-linolenoyl-sn-glycero-3-phosphocholine
1-Docosanyl-2-(6Z,9Z,12Z-octadecatrienoyl)-sn-glycero-3-phosphocholine
Gpcho(22:0/18:3)
Gpcho(22:0/18:3W6)
Gpcho(22:0/18:3n6)
Gpcho(40:3)
Lecithin
PC Ae C40:3
PC(22:0/18:3)
PC(22:0/18:3W6)
PC(22:0/18:3n6)
PC(40:3)
PC(O-40:3)
PC(o-22:0/18:3(6Z,9Z,12Z))
Phosphatidylcholine(22:0/18:3)
Phosphatidylcholine(22:0/18:3W6)
Phosphatidylcholine(22:0/18:3n6)
Phosphatidylcholine(40:3)

hmdb:HMDB13445 		secondary/obsolete/fantasy identifier