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1-(9Z,12Z,15Z,18Z-tetracosatetraenoyl)-2-(11Z,14Z,17Z,20Z,23Z-hexacosapentaenoyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM961421 Image of MNXM961421
referenceslm:000653806
formulaC77H121NO9P
global charge-1
mol weight1235.787
InChIKeyHKNZQPVWAHRMAC-LYDICOBCSA-M
InChIInChI=1S/C77H122NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-36-37-39-42-45-48-51-54-57-60-63-66-69-77(81)87-74(72-84-76(80)68-65-62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)73-86-88(82,83)85-71-70-78-75(79)67-64-61-58-55-52-49-46-43-40-33-30-27-24-21-18-15-12-9-6-3/h7,9-10,12,16-21,25-30,34-36,38-40,42-44,47,49,52,58,61,74H,4-6,8,11,13-15,22-24,31-33,37,41,45-46,48,50-51,53-57,59-60,62-73H2,1-3H3,(H,78,79)(H,82,83)/p-1/b10-7-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,36-34-,38-35-,42-39-,43-40-,47-44-,52-49-,61-58-/t74-/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)CCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC
MNX internals
InChI (mnx)InChI=1/C77H122NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-36-37-39-42-45-48-51-54-57-60-63-66-69-77(81)87-74(72-84-76(80)68-65-62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)73-86-88(82,83)85-71-70-78-75(79)67-64-61-58-55-52-49-46-43-40-33-30-27-24-21-18-15-12-9-6-3/h7,9-10,12,16-21,25-30,34-36,38-40,42-44,47,49,52,58,61,74H,4-6,8,11,13-15,22-24,31-33,37,41,45-46,48,50-51,53-57,59-60,62-73H2,1-3H3,(H,78,79)(H,82,83)/b10-7-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,36-34-,38-35-,42-39-,43-40-,47-44-,52-49-,61-58-/t74-/m1/s1 Image of MNXM961421
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:34]=[CH:36]\[CH2:37]/[CH:39]=[CH:42]\[CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][CH2:66][CH2:69][C:77](=[O:81])[O:87][C@H:74]([CH2:72][O:84][C:76]([CH2:68][CH2:65][CH2:62][CH2:59][CH2:56][CH2:53][CH2:50]/[CH:47]=[CH:44]\[CH2:41]/[CH:38]=[CH:35]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:80])[CH2:73][O:86][P:88]([OH:82])(=[O:83])[O:85][CH2:71][CH2:70][N:78]=[C:75]([CH2:67][CH2:64]/[CH:61]=[CH:58]\[CH2:55]/[CH:52]=[CH:49]\[CH2:46]/[CH:43]=[CH:40]\[CH2:33]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15]/[CH:12]=[CH:9]\[CH2:6][CH3:3])[OH:79]
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:000653806
slm:000653806
HKNZQPVWAHRMAC-LYDICOBCSA-M 		1-(9Z,12Z,15Z,18Z-tetracosatetraenoyl)-2-(11Z,14Z,17Z,20Z,23Z-hexacosapentaenoyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine
N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-1-(9Z,12Z,15Z,18Z-tetracosatetraenoyl)-2-(11Z,14Z,17Z,20Z,23Z-hexacosapentaenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (24:4(9Z,12Z,15Z,18Z)/26:5(11Z,14Z,17Z,20Z,23Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))