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PE(16:1(9Z)/18:3(9Z,12Z,15Z))

PropertiesImage
MNX_IDMNXM32516 Image of MNXM32516
referencechebi:182029
formulaC39H70NO8P
global charge0
mol weight711.962
InChIKeyBMBUWKNHXZNMFT-BVEGXQDJSA-N
InChIInChI=1S/C39H70NO8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40)35-45-38(41)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-18,37H,3-4,6,8-10,12,15,19-36,40H2,1-2H3,(H,43,44)/b7-5-,13-11-,16-14-,18-17-/t37-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCC)COP(=O)(O)OCCN
MNX internals
InChI (mnx)InChI=1/C39H70NO8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40)35-45-38(41)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-18,37H,3-4,6,8-10,12,15,19-36,40H2,1-2H3,(H,43,44)/b7-5-,13-11-,16-14-,18-17-/t37-/m1/s1 Image of MNXM32516
SMILES (mnx)[CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:18]\[CH2:20][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][C:39](=[O:42])[O:48][C@H:37]([CH2:35][O:45][C:38]([CH2:31][CH2:29][CH2:27][CH2:25][CH2:23][CH2:21][CH2:19]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:41])[CH2:36][O:47][P:49]([OH:43])(=[O:44])[O:46][CH2:34][CH2:33][NH2:40]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:182029
chebi:182029
BMBUWKNHXZNMFT-BVEGXQDJSA-N 		PE(16:1(9Z)/18:3(9Z,12Z,15Z))
[(2R)-1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(Z)-hexadec-9-enoyl]oxypropan-2-yl] (9Z,12Z,15Z)-octadeca-9,12,15-trienoate

seed.compound:cpd25139
seedM:cpd25139
BMBUWKNHXZNMFT-BVEGXQDJSA-N 		1-(9Z-hexadecenoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphoethanolamine
1-16:1-2-18:3-phosphatidylethanolamine
16:1-18:3-PE
phosphatidylethanolamine (1-16:1-2-18:3)

SLM:000034657
slm:000034657
BMBUWKNHXZNMFT-BVEGXQDJSA-N 		1-(9Z-hexadecenoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphoethanolamine
PE(16:1(9Z)/18:3(9Z,12Z,15Z))
Phosphatidylethanolamine (16:1(9Z)/18:3(9Z,12Z,15Z))

metacyc.compound:CPD-8288
metacycM:CPD-8288
BMBUWKNHXZNMFT-BVEGXQDJSA-N 		1-16:1-2-18:3-phosphatidylethanolamine
1-(9Z-hexadecenoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphoethanolamine
16:1-18:3-PE
phosphatidylethanolamine (1-16:1-2-18:3)
hmdb:HMDB0008963
BMBUWKNHXZNMFT-BVEGXQDJSA-N 		PE(16:1(9Z)/18:3(9Z,12Z,15Z))
(2-aminoethoxy)[(2R)-3-[(9Z)-hexadec-9-enoyloxy]-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propoxy]phosphinic acid
1-(9Z-Hexadecenoyl)-2-(9Z,12Z,15Z-octadeatrienoyl)-sn-glycero-3-phosphoethanolamine
1-Palmitoleoyl-2-a-linolenoyl-sn-glycero-3-phosphoethanolamine
2-aminoethoxy(2R)-3-[(9Z)-hexadec-9-enoyloxy]-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propoxyphosphinic acid
GPEtn(16:1/18:3)
GPEtn(34:4)
PE(16:1/18:3)
PE(34:4)
Phophatidylethanolamine(16:1/18:3)
Phophatidylethanolamine(34:4)

lipidmaps:LMGP02010526
lipidmapsM:LMGP02010526
BMBUWKNHXZNMFT-BVEGXQDJSA-N 		PE(16:1(9Z)/18:3(9Z,12Z,15Z))
1-(9Z-hexadecenoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-glycero-3-phosphoethanolamine
PE 34:4
PE(16:1_18:3)
PE(34:4)

hmdb:HMDB08963
seedM:M_cpd25139 		secondary/obsolete/fantasy identifier