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1-(17Z,20Z,23Z,26Z-dotriacontatetraenoyl)-2-heptadecanoyl-sn-glycero-3-phospho-N-octadecanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM966865 Image of MNXM966865
referenceslm:000659250
formulaC72H133NO9P
global charge-1
mol weight1187.828
InChIKeySGSUOQKPRYTFSW-VLXLGBFQSA-M
InChIInChI=1S/C72H134NO9P/c1-4-7-10-13-16-19-22-25-28-29-30-31-32-33-34-35-36-37-38-39-40-41-43-46-48-51-54-57-60-63-71(75)79-67-69(82-72(76)64-61-58-55-52-49-45-27-24-21-18-15-12-9-6-3)68-81-83(77,78)80-66-65-73-70(74)62-59-56-53-50-47-44-42-26-23-20-17-14-11-8-5-2/h16,19,25,28,30-31,33-34,69H,4-15,17-18,20-24,26-27,29,32,35-68H2,1-3H3,(H,73,74)(H,77,78)/p-1/b19-16-,28-25-,31-30-,34-33-/t69-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C72H134NO9P/c1-4-7-10-13-16-19-22-25-28-29-30-31-32-33-34-35-36-37-38-39-40-41-43-46-48-51-54-57-60-63-71(75)79-67-69(82-72(76)64-61-58-55-52-49-45-27-24-21-18-15-12-9-6-3)68-81-83(77,78)80-66-65-73-70(74)62-59-56-53-50-47-44-42-26-23-20-17-14-11-8-5-2/h16,19,25,28,30-31,33-34,69H,4-15,17-18,20-24,26-27,29,32,35-68H2,1-3H3,(H,73,74)(H,77,78)/b19-16-,28-25-,31-30-,34-33-/t69-/m1/s1 Image of MNXM966865
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:29]/[CH:30]=[CH:31]\[CH2:32]/[CH:33]=[CH:34]\[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:43][CH2:46][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][C:71](=[O:75])[O:79][CH2:67][C@H:69]([CH2:68][O:81][P:83]([OH:77])(=[O:78])[O:80][CH2:66][CH2:65][N:73]=[C:70]([CH2:62][CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:42][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH:74])[O:82][C:72]([CH2:64][CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:45][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:76]
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:000659250
slm:000659250
SGSUOQKPRYTFSW-VLXLGBFQSA-M
1-(17Z,20Z,23Z,26Z-dotriacontatetraenoyl)-2-heptadecanoyl-sn-glycero-3-phospho-N-octadecanoyl-ethanolamine
N-octadecanoyl-1-(17Z,20Z,23Z,26Z-dotriacontatetraenoyl)-2-heptadecanoyl-sn-glycero-3-phosphoethanolamine
NAPE (32:4(17Z,20Z,23Z,26Z)/17:0/18:0)