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1-(19Z,22Z,25Z,28Z,31Z-tetratriacontapentaenoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM938209 Image of MNXM938209
referenceslm:000630594
formulaC81H129NO9P
global charge-1
mol weight1291.895
InChIKeyWMRRJIBWIUAPME-KAISGPFCSA-M
InChIInChI=1S/C81H130NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-34-35-36-37-38-39-40-41-42-43-44-46-49-51-54-57-60-63-66-69-72-80(84)88-76-78(91-81(85)73-70-67-64-61-58-55-52-47-30-27-24-21-18-15-12-9-6-3)77-90-92(86,87)89-75-74-82-79(83)71-68-65-62-59-56-53-50-48-45-32-29-26-23-20-17-14-11-8-5-2/h7-8,10-11,16-21,25-30,33-34,36-37,45,48,52-53,55-56,61-62,64-65,78H,4-6,9,12-15,22-24,31-32,35,38-44,46-47,49-51,54,57-60,63,66-77H2,1-3H3,(H,82,83)(H,86,87)/p-1/b10-7-,11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,34-33-,37-36-,48-45-,55-52-,56-53-,64-61-,65-62-/t78-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)NCCOP(=O)([O-])OC[C@@H](COC(=O)CCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)OC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C81H130NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-34-35-36-37-38-39-40-41-42-43-44-46-49-51-54-57-60-63-66-69-72-80(84)88-76-78(91-81(85)73-70-67-64-61-58-55-52-47-30-27-24-21-18-15-12-9-6-3)77-90-92(86,87)89-75-74-82-79(83)71-68-65-62-59-56-53-50-48-45-32-29-26-23-20-17-14-11-8-5-2/h7-8,10-11,16-21,25-30,33-34,36-37,45,48,52-53,55-56,61-62,64-65,78H,4-6,9,12-15,22-24,31-32,35,38-44,46-47,49-51,54,57-60,63,66-77H2,1-3H3,(H,82,83)(H,86,87)/b10-7-,11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,34-33-,37-36-,48-45-,55-52-,56-53-,64-61-,65-62-/t78-/m1/s1 Image of MNXM938209
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:31]/[CH:33]=[CH:34]\[CH2:35]/[CH:36]=[CH:37]\[CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:46][CH2:49][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][CH2:66][CH2:69][CH2:72][C:80](=[O:84])[O:88][CH2:76][C@H:78]([CH2:77][O:90][P:92]([OH:86])(=[O:87])[O:89][CH2:75][CH2:74][N:82]=[C:79]([CH2:71][CH2:68]/[CH:65]=[CH:62]\[CH2:59]/[CH:56]=[CH:53]\[CH2:50]/[CH:48]=[CH:45]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])[OH:83])[O:91][C:81]([CH2:73][CH2:70][CH2:67]/[CH:64]=[CH:61]\[CH2:58]/[CH:55]=[CH:52]\[CH2:47]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:85]
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

SLM:000630594
slm:000630594
WMRRJIBWIUAPME-KAISGPFCSA-M 		1-(19Z,22Z,25Z,28Z,31Z-tetratriacontapentaenoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine
N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-1-(19Z,22Z,25Z,28Z,31Z-tetratriacontapentaenoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (34:5(19Z,22Z,25Z,28Z,31Z)/20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))