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1-O-(15-methylhexadecyl)-2-(13Z-docosenoyl)-sn-glycero-3-phospho-N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM1031400 Image of MNXM1031400
referenceslm:000723789
formulaC64H117NO8P
global charge-1
mol weight1059.613
InChIKeyYBNVLOYTENBJRY-GQFZAAETSA-M
InChIInChI=1S/C64H118NO8P/c1-5-7-9-11-13-15-17-19-21-23-24-26-28-30-35-39-43-47-51-55-64(67)73-62(59-70-57-52-48-44-40-36-32-31-33-37-41-45-49-53-61(3)4)60-72-74(68,69)71-58-56-65-63(66)54-50-46-42-38-34-29-27-25-22-20-18-16-14-12-10-8-6-2/h14,16,19-22,27,29,38,42,61-62H,5-13,15,17-18,23-26,28,30-37,39-41,43-60H2,1-4H3,(H,65,66)(H,68,69)/p-1/b16-14-,21-19-,22-20-,29-27-,42-38-/t62-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCOP(=O)([O-])OC[C@@H](COCCCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C64H118NO8P/c1-5-7-9-11-13-15-17-19-21-23-24-26-28-30-35-39-43-47-51-55-64(67)73-62(59-70-57-52-48-44-40-36-32-31-33-37-41-45-49-53-61(3)4)60-72-74(68,69)71-58-56-65-63(66)54-50-46-42-38-34-29-27-25-22-20-18-16-14-12-10-8-6-2/h14,16,19-22,27,29,38,42,61-62H,5-13,15,17-18,23-26,28,30-37,39-41,43-60H2,1-4H3,(H,65,66)(H,68,69)/b16-14-,21-19-,22-20-,29-27-,42-38-/t62-/m1/s1 Image of MNXM1031400
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17]/[CH:19]=[CH:21]\[CH2:23][CH2:24][CH2:26][CH2:28][CH2:30][CH2:35][CH2:39][CH2:43][CH2:47][CH2:51][CH2:55][C:64](=[O:67])[O:73][C@H:62]([CH2:59][O:70][CH2:57][CH2:52][CH2:48][CH2:44][CH2:40][CH2:36][CH2:32][CH2:31][CH2:33][CH2:37][CH2:41][CH2:45][CH2:49][CH2:53][CH:61]([CH3:3])[CH3:4])[CH2:60][O:72][P:74]([OH:68])(=[O:69])[O:71][CH2:58][CH2:56][N:65]=[C:63]([CH2:54][CH2:50][CH2:46]/[CH:42]=[CH:38]\[CH2:34]/[CH:29]=[CH:27]\[CH2:25]/[CH:22]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])[OH:66]
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:000723789
slm:000723789
YBNVLOYTENBJRY-GQFZAAETSA-M
1-O-(15-methylhexadecyl)-2-(13Z-docosenoyl)-sn-glycero-3-phospho-N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-ethanolamine
N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-1-O-(15-methylhexadecyl)-2-(13Z-docosenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (O-17:0(15-me)/22:1(13Z)/20:4(5Z,8Z,11Z,14Z))