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1,2-di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphoethanolamine

PropertiesImage
MNX_IDMNXM32583 Image of MNXM32583
referencechebi:189858
formulaC41H70NO8P
global charge0
mol weight735.984
InChIKeyWIHSZOXPODIZSW-KJIWEYRQSA-N
InChIInChI=1S/C41H70NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(43)47-37-39(38-49-51(45,46)48-36-35-42)50-41(44)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,39H,3-4,9-10,15-16,21-38,42H2,1-2H3,(H,45,46)/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t39-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC
MNX internals
InChI (mnx)InChI=1/C41H70NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(43)47-37-39(38-49-51(45,46)48-36-35-42)50-41(44)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,39H,3-4,9-10,15-16,21-38,42H2,1-2H3,(H,45,46)/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t39-/m1/s1 Image of MNXM32583
SMILES (mnx)[CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][C:40](=[O:43])[O:47][CH2:37][C@H:39]([CH2:38][O:49][P:51]([OH:45])(=[O:46])[O:48][CH2:36][CH2:35][NH2:42])[O:50][C:41]([CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10]/[CH:8]=[CH:6]\[CH2:4][CH3:2])=[O:44]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:189858
chebi:189858
WIHSZOXPODIZSW-KJIWEYRQSA-N 		1,2-di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphoethanolamine
1,2-di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphoethanolamine zwitterion
PE (18:3(9Z,12Z,15Z)/18: 3(9Z,12Z,15Z)) zwitterion

seed.compound:cpd25148
seedM:cpd25148
WIHSZOXPODIZSW-KJIWEYRQSA-N 		1,2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphoethanolamine
1-18:3-2-18:3-phosphatidylethanolamine
18:3-18:3-PE
phosphatidylethanolamine (1-18:3-2-18:3)

SLM:000034894
slm:000034894
WIHSZOXPODIZSW-KJIWEYRQSA-N 		1,2-di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphoethanolamine
PE(18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z))
Phosphatidylethanolamine (18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z))

metacyc.compound:CPD-8297
metacycM:CPD-8297
WIHSZOXPODIZSW-KJIWEYRQSA-N 		1-18:3-2-18:3-phosphatidylethanolamine
1,2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphoethanolamine
18:3-18:3-PE
phosphatidylethanolamine (1-18:3-2-18:3)
hmdb:HMDB0009161
WIHSZOXPODIZSW-KJIWEYRQSA-N 		PE(18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z))
(2-aminoethoxy)[(2R)-2,3-bis[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propoxy]phosphinic acid
1,2-Di(9Z,12Z,15Z-octadeatrienoyl)-rac-glycero-3-phosphoethanolamine
1,2-Dia-linolenoyl-rac-glycero-3-phosphoethanolamine
2-aminoethoxy(2R)-2,3-bis[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propoxyphosphinic acid
GPEtn(18:3/18:3)
GPEtn(36:6)
PE(18:3/18:3)
PE(36:6)
Phophatidylethanolamine(18:3/18:3)
Phophatidylethanolamine(36:6)

CHEBI:137159
chebi:137159
WIHSZOXPODIZSW-KJIWEYRQSA-N 		PE(18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z))
1,2-di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphoethanolamine

lipidmaps:LMGP02011189
lipidmapsM:LMGP02011189
WIHSZOXPODIZSW-KJIWEYRQSA-N 		PE(18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z))
1,2-di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphoethanolamine
PE 36:6
PE(18:3_18:3)
PE(36:6)

hmdb:HMDB09161
seedM:M_cpd25148 		secondary/obsolete/fantasy identifier