1-(15Z,18Z,21Z,24Z-triacontatetraenoyl)-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine

Properties Image MNX_ID MNXM965397 reference slm:000657782 formula C79H125NO9P global charge -1 mol weight 1263.841 InChIKey BOOCDOPPTOVTON-FAHOSXQFSA-M InChI InChI=1S/C79H126NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-35-36-37-38-39-40-41-44-46-49-52-55-58-61-64-67-70-78(82)86-74-76(89-79(83)71-68-65-62-59-56-53-50-47-43-33-30-27-24-21-18-15-12-9-6-3)75-88-90(84,85)87-73-72-80-77(81)69-66-63-60-57-54-51-48-45-42-32-29-26-23-20-17-14-11-8-5-2/h8,11,16-21,25-30,34-35,37-38,42-43,45,47,51,53-54,56,60,62-63,65,76H,4-7,9-10,12-15,22-24,31-33,36,39-41,44,46,48-50,52,55,57-59,61,64,66-75H2,1-3H3,(H,80,81)(H,84,85)/p-1/b11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,35-34-,38-37-,45-42-,47-43-,54-51-,56-53-,63-60-,65-62-/t76-/m1/s1 SMILES CC/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)CCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC MNX internals InChI (mnx) InChI=1/C79H126NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-35-36-37-38-39-40-41-44-46-49-52-55-58-61-64-67-70-78(82)86-74-76(89-79(83)71-68-65-62-59-56-53-50-47-43-33-30-27-24-21-18-15-12-9-6-3)75-88-90(84,85)87-73-72-80-77(81)69-66-63-60-57-54-51-48-45-42-32-29-26-23-20-17-14-11-8-5-2/h8,11,16-21,25-30,34-35,37-38,42-43,45,47,51,53-54,56,60,62-63,65,76H,4-7,9-10,12-15,22-24,31-33,36,39-41,44,46,48-50,52,55,57-59,61,64,66-75H2,1-3H3,(H,80,81)(H,84,85)/b11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,35-34-,38-37-,45-42-,47-43-,54-51-,56-53-,63-60-,65-62-/t76-/m1/s1 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:34]=[CH:35]\[CH2:36]/[CH:37]=[CH:38]\[CH2:39][CH2:40][CH2:41][CH2:44][CH2:46][CH2:49][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]\[CH2:48]/[CH:45]=[CH:42]\[CH2:32]/[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]/[CH:65]=[CH:62]\[CH2:59]/[CH:56]=[CH:53]\[CH2:50]/[CH:47]=[CH:43]\[CH2:33]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][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