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1-(19Z,22Z,25Z,28Z,31Z-tetratriacontapentaenoyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phospho-N-decanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM937993 Image of MNXM937993
referenceslm:000630378
formulaC71H117NO9P
global charge-1
mol weight1159.689
InChIKeyCWYRVYSCSDWOPF-TWSOQXFJSA-M
InChIInChI=1S/C71H118NO9P/c1-4-7-10-13-16-18-20-22-24-26-28-29-30-31-32-33-34-35-36-37-38-39-41-42-44-46-48-50-53-56-59-62-70(74)78-66-68(67-80-82(76,77)79-65-64-72-69(73)61-58-55-52-15-12-9-6-3)81-71(75)63-60-57-54-51-49-47-45-43-40-27-25-23-21-19-17-14-11-8-5-2/h7-8,10-11,16-19,22-25,28-29,31-32,40,43,47,49,54,57,68H,4-6,9,12-15,20-21,26-27,30,33-39,41-42,44-46,48,50-53,55-56,58-67H2,1-3H3,(H,72,73)(H,76,77)/p-1/b10-7-,11-8-,18-16-,19-17-,24-22-,25-23-,29-28-,32-31-,43-40-,49-47-,57-54-/t68-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)COP(=O)([O-])OCCNC(=O)CCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C71H118NO9P/c1-4-7-10-13-16-18-20-22-24-26-28-29-30-31-32-33-34-35-36-37-38-39-41-42-44-46-48-50-53-56-59-62-70(74)78-66-68(67-80-82(76,77)79-65-64-72-69(73)61-58-55-52-15-12-9-6-3)81-71(75)63-60-57-54-51-49-47-45-43-40-27-25-23-21-19-17-14-11-8-5-2/h7-8,10-11,16-19,22-25,28-29,31-32,40,43,47,49,54,57,68H,4-6,9,12-15,20-21,26-27,30,33-39,41-42,44-46,48,50-53,55-56,58-67H2,1-3H3,(H,72,73)(H,76,77)/b10-7-,11-8-,18-16-,19-17-,24-22-,25-23-,29-28-,32-31-,43-40-,49-47-,57-54-/t68-/m1/s1 Image of MNXM937993
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:18]\[CH2:20]/[CH:22]=[CH:24]\[CH2:26]/[CH:28]=[CH:29]\[CH2:30]/[CH:31]=[CH:32]\[CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:41][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:53][CH2:56][CH2:59][CH2:62][C:70](=[O:74])[O:78][CH2:66][C@H:68]([CH2:67][O:80][P:82]([OH:76])(=[O:77])[O:79][CH2:65][CH2:64][N:72]=[C:69]([CH2:61][CH2:58][CH2:55][CH2:52][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:73])[O:81][C:71]([CH2:63][CH2:60]/[CH:57]=[CH:54]\[CH2:51]/[CH:49]=[CH:47]\[CH2:45]/[CH:43]=[CH:40]\[CH2:27]/[CH:25]=[CH:23]\[CH2:21]/[CH:19]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:75]
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:000630378
slm:000630378
CWYRVYSCSDWOPF-TWSOQXFJSA-M 		1-(19Z,22Z,25Z,28Z,31Z-tetratriacontapentaenoyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phospho-N-decanoyl-ethanolamine
N-decanoyl-1-(19Z,22Z,25Z,28Z,31Z-tetratriacontapentaenoyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (34:5(19Z,22Z,25Z,28Z,31Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/10:0)