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1-O-(1Z,13Z-octadecadienyl)-2-(16Z,19Z,22Z,25Z,28Z-tetratriacontapentaenoyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM1025727 Image of MNXM1025727
referenceslm:000718116
formulaC79H131NO8P
global charge-1
mol weight1253.89
InChIKeyBHIOQLYPDHRXLY-GAIQLPGYSA-M
InChIInChI=1S/C79H132NO8P/c1-4-7-10-13-16-19-22-25-28-31-33-34-35-36-37-38-39-40-41-42-43-44-46-48-50-53-56-59-62-65-68-71-79(82)88-77(75-85-73-69-66-63-60-57-54-51-30-27-24-21-18-15-12-9-6-3)76-87-89(83,84)86-74-72-80-78(81)70-67-64-61-58-55-52-49-47-45-32-29-26-23-20-17-14-11-8-5-2/h8,11,15-20,25-26,28-29,33-34,36-37,39-40,45,47,52,55,61,64,69,73,77H,4-7,9-10,12-14,21-24,27,30-32,35,38,41-44,46,48-51,53-54,56-60,62-63,65-68,70-72,74-76H2,1-3H3,(H,80,81)(H,83,84)/p-1/b11-8-,18-15-,19-16-,20-17-,28-25-,29-26-,34-33-,37-36-,40-39-,47-45-,55-52-,64-61-,73-69-/t77-/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](CO/C=C\CCCCCCCCCC/C=C\CCCC)OC(=O)CCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C79H132NO8P/c1-4-7-10-13-16-19-22-25-28-31-33-34-35-36-37-38-39-40-41-42-43-44-46-48-50-53-56-59-62-65-68-71-79(82)88-77(75-85-73-69-66-63-60-57-54-51-30-27-24-21-18-15-12-9-6-3)76-87-89(83,84)86-74-72-80-78(81)70-67-64-61-58-55-52-49-47-45-32-29-26-23-20-17-14-11-8-5-2/h8,11,15-20,25-26,28-29,33-34,36-37,39-40,45,47,52,55,61,64,69,73,77H,4-7,9-10,12-14,21-24,27,30-32,35,38,41-44,46,48-51,53-54,56-60,62-63,65-68,70-72,74-76H2,1-3H3,(H,80,81)(H,83,84)/b11-8-,18-15-,19-16-,20-17-,28-25-,29-26-,34-33-,37-36-,40-39-,47-45-,55-52-,64-61-,73-69-/t77-/m1/s1 Image of MNXM1025727
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][CH2:46][CH2:48][CH2:50][CH2:53][CH2:56][CH2:59][CH2:62][CH2:65][CH2:68][CH2:71][C:79](=[O:82])[O:88][C@H:77]([CH2:75][O:85]/[CH:73]=[CH:69]\[CH2:66][CH2:63][CH2:60][CH2:57][CH2:54][CH2:51][CH2:30][CH2:27][CH2:24][CH2:21]/[CH:18]=[CH:15]\[CH2:12][CH2:9][CH2:6][CH3:3])[CH2:76][O:87][P:89]([OH:83])(=[O:84])[O:86][CH2:74][CH2:72][N:80]=[C:78]([CH2:70][CH2:67]/[CH:64]=[CH:61]\[CH2:58]/[CH:55]=[CH:52]\[CH2:49]/[CH:47]=[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:81]
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:000718116
slm:000718116
BHIOQLYPDHRXLY-GAIQLPGYSA-M 		1-O-(1Z,13Z-octadecadienyl)-2-(16Z,19Z,22Z,25Z,28Z-tetratriacontapentaenoyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine
N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-1-O-(1Z,13Z-octadecadienyl)-2-(16Z,19Z,22Z,25Z,28Z-tetratriacontapentaenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (P-18:1(13Z)/34:5(16Z,19Z,22Z,25Z,28Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))