Search MNXref
 Feedback

1-(9Z,12Z,15Z-octadecatrienoyl)-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM7982 Image of MNXM7982
referencechebi:89439
formulaC44H78NO8P
global charge0
mol weight780.081
InChIKeyQFDYIDGUKXRPKH-VSLGLSMXSA-N
InChIInChI=1S/C44H78NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h8,10,14-17,20-23,42H,6-7,9,11-13,18-19,24-41H2,1-5H3/b10-8-,16-14-,17-15-,22-20-,23-21-/t42-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C44H78NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h8,10,14-17,20-23,42H,6-7,9,11-13,18-19,24-41H2,1-5H3/b10-8-,16-14-,17-15-,22-20-,23-21-/t42-/m1/s1 Image of MNXM7982
SMILES (mnx)[CH3:1][CH2:6]/[CH:8]=[CH:10]\[CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][C:43](=[O:46])[O:50][CH2:40][C@H:42]([CH2:41][O:52][P:54](=[O:48])([O-:49])[O:51][CH2:39][CH2:38][N+:45]([CH3:3])([CH3:4])[CH3:5])[O:53][C:44]([CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25]/[CH:23]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:47]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)10
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:89439
chebi:89439
QFDYIDGUKXRPKH-VSLGLSMXSA-N 		1-(9Z,12Z,15Z-octadecatrienoyl)-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphocholine
1-a-Linolenoyl-2-linoleoyl-sn-glycero-3-phosphocholine
1-alpha-Linolenoyl-2-linoleoyl-sn-glycero-3-phosphocholine
GPCho(18:3/18:2)
GPCho(18:3n3/18:2n6)
GPCho(18:3w3/18:2w6)
GPCho(36:5)
Lecithin
PC aa C36:5
PC(18:3(9Z,12Z,15Z)/18:2(9Z,12Z))
PC(18:3/18:2)
PC(18:3n3/18:2n6)
PC(18:3w3/18:2w6)
PC(36:5)
Phosphatidylcholine(18:3/18:2)
Phosphatidylcholine(18:3n3/18:2n6)
Phosphatidylcholine(18:3w3/18:2w6)
Phosphatidylcholine(36:5)
trimethyl(2-{[(2R)-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]-2-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propyl phosphonato]oxy}ethyl)azanium

SLM:000012002
slm:000012002
QFDYIDGUKXRPKH-VSLGLSMXSA-N 		1-(9Z,12Z,15Z-octadecatrienoyl)-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphocholine
PC(18:3(9Z,12Z,15Z)/18:2(9Z,12Z))
Phosphatidylcholine (18:3(9Z,12Z,15Z)/18:2(9Z,12Z))

seed.compound:cpd25040
seedM:cpd25040
QFDYIDGUKXRPKH-VSLGLSMXSA-N 		1-18:3-2-18:2-phosphatidylcholine
1-alpha-linolenoyl-2-linoleoyl-phosphatidylcholine
18:3-18:2-PC
phosphatidylcholine (1-18:3-2-18:2)

metacyc.compound:CPD-8090
metacycM:CPD-8090
QFDYIDGUKXRPKH-VSLGLSMXSA-N 		1-alpha-linolenoyl-2-linoleoyl-phosphatidylcholine
1-18:3-2-18:2-phosphatidylcholine
18:3-18:2-PC
phosphatidylcholine (1-18:3-2-18:2)
hmdb:HMDB0008204
QFDYIDGUKXRPKH-VSLGLSMXSA-N 		PC(18:3(9Z,12Z,15Z)/18:2(9Z,12Z))
1-(9Z,12Z,15Z-octadeatrienoyl)-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphocholine
1-a-linolenoyl-2-linoleoyl-sn-glycero-3-phosphocholine
GPCho(18:3/18:2)
GPCho(36:5)
Lecithin
PC(18:3/18:2)
PC(36:5)
Phosphatidylcholine(18:3/18:2)
Phosphatidylcholine(36:5)
lecithin
trimethyl(2-{[(2R)-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]-2-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propyl phosphonato]oxy}ethyl)azanium

lipidmaps:LMGP01011683
lipidmapsM:LMGP01011683
QFDYIDGUKXRPKH-VSLGLSMXSA-N 		PC(18:3(9Z,12Z,15Z)/18:2(9Z,12Z))
1-(9Z,12Z,15Z-octadecatrienoyl)-2-(9Z,12Z-octadecadienoyl)-glycero-3-phosphocholine
PC 36:5
PC(18:2_18:3)
PC(36:5)

hmdb:HMDB08204
seedM:M_cpd25040 		secondary/obsolete/fantasy identifier