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1-(19Z,22Z,25Z,28Z-tetratriacontatetraenoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM967203 Image of MNXM967203
referenceslm:000659588
formulaC79H129NO9P
global charge-1
mol weight1267.873
InChIKeyLWBSFKFXPNXOGD-HJEZCGNCSA-M
InChIInChI=1S/C79H130NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-35-36-37-38-39-40-41-42-43-45-47-50-52-55-58-61-64-67-70-78(82)86-74-76(89-79(83)71-68-65-62-59-56-53-48-27-24-21-18-15-12-9-6-3)75-88-90(84,85)87-73-72-80-77(81)69-66-63-60-57-54-51-49-46-44-31-29-26-23-20-17-14-11-8-5-2/h8-9,11-12,16-21,25-29,32-33,35-36,44,46,48,51,54,60,63,76H,4-7,10,13-15,22-24,30-31,34,37-43,45,47,49-50,52-53,55-59,61-62,64-75H2,1-3H3,(H,80,81)(H,84,85)/p-1/b11-8-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,33-32-,36-35-,46-44-,48-27-,54-51-,63-60-/t76-/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)CCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC
MNX internals
InChI (mnx)InChI=1/C79H130NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-35-36-37-38-39-40-41-42-43-45-47-50-52-55-58-61-64-67-70-78(82)86-74-76(89-79(83)71-68-65-62-59-56-53-48-27-24-21-18-15-12-9-6-3)75-88-90(84,85)87-73-72-80-77(81)69-66-63-60-57-54-51-49-46-44-31-29-26-23-20-17-14-11-8-5-2/h8-9,11-12,16-21,25-29,32-33,35-36,44,46,48,51,54,60,63,76H,4-7,10,13-15,22-24,30-31,34,37-43,45,47,49-50,52-53,55-59,61-62,64-75H2,1-3H3,(H,80,81)(H,84,85)/b11-8-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,33-32-,36-35-,46-44-,48-27-,54-51-,63-60-/t76-/m1/s1 Image of MNXM967203
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:32]=[CH:33]\[CH2:34]/[CH:35]=[CH:36]\[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:45][CH2:47][CH2:50][CH2:52][CH2:55][CH2:58][CH2:61][CH2:64][CH2:67][CH2:70][C:78](=[O:82])[O:86][CH2:74][C@H:76]([CH2:75][O:88][P:90]([OH:84])(=[O:85])[O:87][CH2:73][CH2:72][N:80]=[C:77]([CH2:69][CH2:66]/[CH:63]=[CH:60]\[CH2:57]/[CH:54]=[CH:51]\[CH2:49]/[CH:46]=[CH:44]\[CH2:31]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])[OH:81])[O:89][C:79]([CH2:71][CH2:68][CH2:65][CH2:62][CH2:59][CH2:56][CH2:53]/[CH:48]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15]/[CH:12]=[CH:9]\[CH2:6][CH3:3])=[O:83]
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:000659588
slm:000659588
LWBSFKFXPNXOGD-HJEZCGNCSA-M 		1-(19Z,22Z,25Z,28Z-tetratriacontatetraenoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine
N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-1-(19Z,22Z,25Z,28Z-tetratriacontatetraenoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphoethanolamine
NAPE (34:4(19Z,22Z,25Z,28Z)/18:3(9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))