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1-(9Z,12Z,15Z,18Z-tetracosatetraenoyl)-2-(13Z,16Z,19Z,22Z,25Z-octacosapentaenoyl)-sn-glycero-3-phospho-N-(6Z,9Z,12Z-octadecatrienoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM961437 Image of MNXM961437
referenceslm:000653822
formulaC75H123NO9P
global charge-1
mol weight1213.781
InChIKeyMCQWSBZZXOBAHZ-VNMYZKPCSA-M
InChIInChI=1S/C75H124NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-34-35-36-37-39-41-43-46-49-52-55-58-61-64-67-75(79)85-72(70-82-74(78)66-63-60-57-54-51-48-45-42-40-38-33-31-29-26-23-20-17-14-11-8-5-2)71-84-86(80,81)83-69-68-76-73(77)65-62-59-56-53-50-47-44-27-24-21-18-15-12-9-6-3/h7,10,16-21,25-29,32-34,36-38,42,44-45,50,53,72H,4-6,8-9,11-15,22-24,30-31,35,39-41,43,46-49,51-52,54-71H2,1-3H3,(H,76,77)(H,80,81)/p-1/b10-7-,19-16-,20-17-,21-18-,28-25-,29-26-,34-32-,37-36-,38-33-,44-27-,45-42-,53-50-/t72-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C75H124NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-34-35-36-37-39-41-43-46-49-52-55-58-61-64-67-75(79)85-72(70-82-74(78)66-63-60-57-54-51-48-45-42-40-38-33-31-29-26-23-20-17-14-11-8-5-2)71-84-86(80,81)83-69-68-76-73(77)65-62-59-56-53-50-47-44-27-24-21-18-15-12-9-6-3/h7,10,16-21,25-29,32-34,36-38,42,44-45,50,53,72H,4-6,8-9,11-15,22-24,30-31,35,39-41,43,46-49,51-52,54-71H2,1-3H3,(H,76,77)(H,80,81)/b10-7-,19-16-,20-17-,21-18-,28-25-,29-26-,34-32-,37-36-,38-33-,44-27-,45-42-,53-50-/t72-/m1/s1 Image of MNXM961437
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:32]=[CH:34]\[CH2:35]/[CH:36]=[CH:37]\[CH2:39][CH2:41][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][CH2:57][CH2:54][CH2:51][CH2:48]/[CH:45]=[CH:42]\[CH2:40]/[CH:38]=[CH:33]\[CH2:31]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[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][CH2:59][CH2:56]/[CH:53]=[CH:50]\[CH2:47]/[CH:44]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[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:000653822
slm:000653822
MCQWSBZZXOBAHZ-VNMYZKPCSA-M 		1-(9Z,12Z,15Z,18Z-tetracosatetraenoyl)-2-(13Z,16Z,19Z,22Z,25Z-octacosapentaenoyl)-sn-glycero-3-phospho-N-(6Z,9Z,12Z-octadecatrienoyl)-ethanolamine
N-(6Z,9Z,12Z-octadecatrienoyl)-1-(9Z,12Z,15Z,18Z-tetracosatetraenoyl)-2-(13Z,16Z,19Z,22Z,25Z-octacosapentaenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (24:4(9Z,12Z,15Z,18Z)/28:5(13Z,16Z,19Z,22Z,25Z)/18:3(6Z,9Z,12Z))