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1-O-(13Z-octadecenyl)-2-(20Z,23Z,26Z,29Z,32Z-octatriacontapentaenoyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM1046923 Image of MNXM1046923
referenceslm:000739312
formulaC83H141NO8P
global charge-1
mol weight1312.014
InChIKeyIZXYYFRNNTWMFV-KEVFCQQISA-M
InChIInChI=1S/C83H142NO8P/c1-4-7-10-13-16-19-22-25-28-31-33-34-35-36-37-38-39-40-41-42-43-44-45-46-47-48-50-52-54-57-60-63-66-69-72-75-83(86)92-81(79-89-77-73-70-67-64-61-58-55-30-27-24-21-18-15-12-9-6-3)80-91-93(87,88)90-78-76-84-82(85)74-71-68-65-62-59-56-53-51-49-32-29-26-23-20-17-14-11-8-5-2/h8,11,15-20,25-26,28-29,33-34,36-37,39-40,49,51,56,59,65,68,81H,4-7,9-10,12-14,21-24,27,30-32,35,38,41-48,50,52-55,57-58,60-64,66-67,69-80H2,1-3H3,(H,84,85)(H,87,88)/p-1/b11-8-,18-15-,19-16-,20-17-,28-25-,29-26-,34-33-,37-36-,40-39-,51-49-,59-56-,68-65-/t81-/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](COCCCCCCCCCCCC/C=C\CCCC)OC(=O)CCCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C83H142NO8P/c1-4-7-10-13-16-19-22-25-28-31-33-34-35-36-37-38-39-40-41-42-43-44-45-46-47-48-50-52-54-57-60-63-66-69-72-75-83(86)92-81(79-89-77-73-70-67-64-61-58-55-30-27-24-21-18-15-12-9-6-3)80-91-93(87,88)90-78-76-84-82(85)74-71-68-65-62-59-56-53-51-49-32-29-26-23-20-17-14-11-8-5-2/h8,11,15-20,25-26,28-29,33-34,36-37,39-40,49,51,56,59,65,68,81H,4-7,9-10,12-14,21-24,27,30-32,35,38,41-48,50,52-55,57-58,60-64,66-67,69-80H2,1-3H3,(H,84,85)(H,87,88)/b11-8-,18-15-,19-16-,20-17-,28-25-,29-26-,34-33-,37-36-,40-39-,51-49-,59-56-,68-65-/t81-/m1/s1 Image of MNXM1046923
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][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]/[CH:39]=[CH:40]\[CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:50][CH2:52][CH2:54][CH2:57][CH2:60][CH2:63][CH2:66][CH2:69][CH2:72][CH2:75][C:83](=[O:86])[O:92][C@H:81]([CH2:79][O:89][CH2:77][CH2:73][CH2:70][CH2:67][CH2:64][CH2:61][CH2:58][CH2:55][CH2:30][CH2:27][CH2:24][CH2:21]/[CH:18]=[CH:15]\[CH2:12][CH2:9][CH2:6][CH3:3])[CH2:80][O:91][P:93]([OH:87])(=[O:88])[O:90][CH2:78][CH2:76][N:84]=[C:82]([CH2:74][CH2:71]/[CH:68]=[CH:65]\[CH2:62]/[CH:59]=[CH:56]\[CH2:53]/[CH:51]=[CH:49]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])[OH: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:000739312
slm:000739312
IZXYYFRNNTWMFV-KEVFCQQISA-M 		1-O-(13Z-octadecenyl)-2-(20Z,23Z,26Z,29Z,32Z-octatriacontapentaenoyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine
N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-1-O-(13Z-octadecenyl)-2-(20Z,23Z,26Z,29Z,32Z-octatriacontapentaenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (O-18:1(13Z)/38:5(20Z,23Z,26Z,29Z,32Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))