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

PropertiesImage
MNX_IDMNXM959083 Image of MNXM959083
referenceslm:000651468
formulaC75H117NO9P
global charge-1
mol weight1207.733
InChIKeyRMOKUSPBOACOFQ-HRWIIRFKSA-M
InChIInChI=1S/C75H118NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-34-35-36-37-38-40-43-46-49-52-55-58-61-64-67-75(79)85-72(70-82-74(78)66-63-60-57-54-51-48-45-41-30-27-24-21-18-15-12-9-6-3)71-84-86(80,81)83-69-68-76-73(77)65-62-59-56-53-50-47-44-42-39-32-29-26-23-20-17-14-11-8-5-2/h7-8,10-11,16-21,25-30,33-34,36-37,39,42,45,47-48,50,54,56-57,59,72H,4-6,9,12-15,22-24,31-32,35,38,40-41,43-44,46,49,51-53,55,58,60-71H2,1-3H3,(H,76,77)(H,80,81)/p-1/b10-7-,11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,34-33-,37-36-,42-39-,48-45-,50-47-,57-54-,59-56-/t72-/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)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC
MNX internals
InChI (mnx)InChI=1/C75H118NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-34-35-36-37-38-40-43-46-49-52-55-58-61-64-67-75(79)85-72(70-82-74(78)66-63-60-57-54-51-48-45-41-30-27-24-21-18-15-12-9-6-3)71-84-86(80,81)83-69-68-76-73(77)65-62-59-56-53-50-47-44-42-39-32-29-26-23-20-17-14-11-8-5-2/h7-8,10-11,16-21,25-30,33-34,36-37,39,42,45,47-48,50,54,56-57,59,72H,4-6,9,12-15,22-24,31-32,35,38,40-41,43-44,46,49,51-53,55,58,60-71H2,1-3H3,(H,76,77)(H,80,81)/b10-7-,11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,34-33-,37-36-,42-39-,48-45-,50-47-,57-54-,59-56-/t72-/m1/s1 Image of MNXM959083
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][CH2:40][CH2:43][CH2:46][CH2:49][CH2:52][CH2:55][CH2:58][CH2:61][CH2:64][CH2:67][C:75](=[O:79])[O:85][C@H:72]([CH2:70][O:82][C:74]([CH2:66][CH2:63][CH2:60]/[CH:57]=[CH:54]\[CH2:51]/[CH:48]=[CH:45]\[CH2:41]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:78])[CH2:71][O:84][P:86]([OH:80])(=[O:81])[O:83][CH2:69][CH2:68][N:76]=[C:73]([CH2:65][CH2:62]/[CH:59]=[CH:56]\[CH2:53]/[CH:50]=[CH:47]\[CH2:44]/[CH:42]=[CH:39]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])[OH:77]
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:000651468
slm:000651468
RMOKUSPBOACOFQ-HRWIIRFKSA-M 		1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-2-(13Z,16Z,19Z,22Z,25Z-octacosapentaenoyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine
N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-2-(13Z,16Z,19Z,22Z,25Z-octacosapentaenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (20:4(5Z,8Z,11Z,14Z)/28:5(13Z,16Z,19Z,22Z,25Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))