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

PropertiesImage
MNX_IDMNXM938153 Image of MNXM938153
referenceslm:000630538
formulaC83H137NO9P
global charge-1
mol weight1323.981
InChIKeyCYOGSHOXSIKWIP-ZVTMRPCTSA-M
InChIInChI=1S/C83H138NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-35-36-37-38-39-40-41-42-43-44-45-48-50-53-56-59-62-65-68-71-74-82(86)90-78-80(93-83(87)75-72-69-66-63-60-57-54-51-47-33-30-27-24-21-18-15-12-9-6-3)79-92-94(88,89)91-77-76-84-81(85)73-70-67-64-61-58-55-52-49-46-32-29-26-23-20-17-14-11-8-5-2/h7-8,10-11,16-21,25-30,34-35,37-38,46,49,55,58,64,67,80H,4-6,9,12-15,22-24,31-33,36,39-45,47-48,50-54,56-57,59-63,65-66,68-79H2,1-3H3,(H,84,85)(H,88,89)/p-1/b10-7-,11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,35-34-,38-37-,49-46-,58-55-,67-64-/t80-/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\C/C=C\CC)OC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C83H138NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-35-36-37-38-39-40-41-42-43-44-45-48-50-53-56-59-62-65-68-71-74-82(86)90-78-80(93-83(87)75-72-69-66-63-60-57-54-51-47-33-30-27-24-21-18-15-12-9-6-3)79-92-94(88,89)91-77-76-84-81(85)73-70-67-64-61-58-55-52-49-46-32-29-26-23-20-17-14-11-8-5-2/h7-8,10-11,16-21,25-30,34-35,37-38,46,49,55,58,64,67,80H,4-6,9,12-15,22-24,31-33,36,39-45,47-48,50-54,56-57,59-63,65-66,68-79H2,1-3H3,(H,84,85)(H,88,89)/b10-7-,11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,35-34-,38-37-,49-46-,58-55-,67-64-/t80-/m1/s1 Image of MNXM938153
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:35]\[CH2:36]/[CH:37]=[CH:38]\[CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:48][CH2:50][CH2:53][CH2:56][CH2:59][CH2:62][CH2:65][CH2:68][CH2:71][CH2:74][C:82](=[O:86])[O:90][CH2:78][C@H:80]([CH2:79][O:92][P:94]([OH:88])(=[O:89])[O:91][CH2:77][CH2:76][N:84]=[C:81]([CH2:73][CH2:70]/[CH:67]=[CH:64]\[CH2:61]/[CH:58]=[CH:55]\[CH2:52]/[CH:49]=[CH:46]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])[OH:85])[O:93][C:83]([CH2:75][CH2:72][CH2:69][CH2:66][CH2:63][CH2:60][CH2:57][CH2:54][CH2:51][CH2:47][CH2:33]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:87]
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:000630538
slm:000630538
CYOGSHOXSIKWIP-ZVTMRPCTSA-M 		1-(19Z,22Z,25Z,28Z,31Z-tetratriacontapentaenoyl)-2-(13Z,16Z-docosadienoyl)-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,31Z-tetratriacontapentaenoyl)-2-(13Z,16Z-docosadienoyl)-sn-glycero-3-phosphoethanolamine
NAPE (34:5(19Z,22Z,25Z,28Z,31Z)/22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))