1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-(18Z,21Z,24Z,27Z,30Z,33Z-hexatriacontahexaenoyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine

Properties Image MNX_ID MNXM939273 reference slm:000631658 formula C99H161NO9P global charge -1 mol weight 1540.349 InChIKey SBVFMTOFVWPUDR-BSXXPOSTSA-M InChI InChI=1S/C99H162NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-36-38-40-42-44-46-48-50-52-54-56-58-60-63-66-69-72-75-78-81-84-87-90-98(102)106-94-96(95-108-110(104,105)107-93-92-100-97(101)89-86-83-80-77-74-71-68-65-62-33-30-27-24-21-18-15-12-9-6-3)109-99(103)91-88-85-82-79-76-73-70-67-64-61-59-57-55-53-51-49-47-45-43-41-39-37-35-32-29-26-23-20-17-14-11-8-5-2/h7-12,16-21,25-30,34-37,40-43,47,49,62,65,71,74,80,83,96H,4-6,13-15,22-24,31-33,38-39,44-46,48,50-61,63-64,66-70,72-73,75-79,81-82,84-95H2,1-3H3,(H,100,101)(H,104,105)/p-1/b10-7-,11-8-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,36-34-,37-35-,42-40-,43-41-,49-47-,65-62-,74-71-,83-80-/t96-/m1/s1 SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)COP(=O)([O-])OCCNC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC MNX internals InChI (mnx) InChI=1/C99H162NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-36-38-40-42-44-46-48-50-52-54-56-58-60-63-66-69-72-75-78-81-84-87-90-98(102)106-94-96(95-108-110(104,105)107-93-92-100-97(101)89-86-83-80-77-74-71-68-65-62-33-30-27-24-21-18-15-12-9-6-3)109-99(103)91-88-85-82-79-76-73-70-67-64-61-59-57-55-53-51-49-47-45-43-41-39-37-35-32-29-26-23-20-17-14-11-8-5-2/h7-12,16-21,25-30,34-37,40-43,47,49,62,65,71,74,80,83,96H,4-6,13-15,22-24,31-33,38-39,44-46,48,50-61,63-64,66-70,72-73,75-79,81-82,84-95H2,1-3H3,(H,100,101)(H,104,105)/b10-7-,11-8-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,36-34-,37-35-,42-40-,43-41-,49-47-,65-62-,74-71-,83-80-/t96-/m1/s1 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]\[CH2:38]/[CH:40]=[CH:42]\[CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:54][CH2:56][CH2:58][CH2:60][CH2:63][CH2:66][CH2:69][CH2:72][CH2:75][CH2:78][CH2:81][CH2:84][CH2:87][CH2:90][C:98](=[O:102])[O:106][CH2:94][C@H:96]([CH2:95][O:108][P:110]([OH:104])(=[O:105])[O:107][CH2:93][CH2:92][N:100]=[C:97]([CH2:89][CH2:86]/[CH:83]=[CH:80]\[CH2:77]/[CH:74]=[CH:71]\[CH2:68]/[CH:65]=[CH:62]\[CH2:33]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15]/[CH:12]=[CH:9]\[CH2:6][CH3:3])[OH:101])[O:109][C:99]([CH2:91][CH2:88][CH2:85][CH2:82][CH2:79][CH2:76][CH2:73][CH2:70][CH2:67][CH2:64][CH2:61][CH2:59][CH2:57][CH2:55][CH2:53][CH2:51]/[CH:49]=[CH:47]\[CH2:45]/[CH:43]=[CH:41]\[CH2:39]/[CH:37]=[CH:35]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:103]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0