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1-O-(1Z,11Z-octadecadienyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM1019612 Image of MNXM1019612
referenceslm:000712001
formulaC61H107NO8P
global charge-1
mol weight1013.5
InChIKeyZQVWKJYTRBHNMS-DIRIQAJTSA-M
InChIInChI=1S/C61H108NO8P/c1-4-7-10-13-16-19-22-25-28-30-32-34-37-40-43-46-49-52-60(63)62-54-56-68-71(65,66)69-58-59(57-67-55-51-48-45-42-39-36-33-29-26-23-20-17-14-11-8-5-2)70-61(64)53-50-47-44-41-38-35-31-27-24-21-18-15-12-9-6-3/h16,19-20,23,25,27-28,31-32,34,40,43,51,55,59H,4-15,17-18,21-22,24,26,29-30,33,35-39,41-42,44-50,52-54,56-58H2,1-3H3,(H,62,63)(H,65,66)/p-1/b19-16-,23-20-,28-25-,31-27-,34-32-,43-40-,55-51-/t59-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCOP(=O)([O-])OC[C@@H](CO/C=C\CCCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C61H108NO8P/c1-4-7-10-13-16-19-22-25-28-30-32-34-37-40-43-46-49-52-60(63)62-54-56-68-71(65,66)69-58-59(57-67-55-51-48-45-42-39-36-33-29-26-23-20-17-14-11-8-5-2)70-61(64)53-50-47-44-41-38-35-31-27-24-21-18-15-12-9-6-3/h16,19-20,23,25,27-28,31-32,34,40,43,51,55,59H,4-15,17-18,21-22,24,26,29-30,33,35-39,41-42,44-50,52-54,56-58H2,1-3H3,(H,62,63)(H,65,66)/b19-16-,23-20-,28-25-,31-27-,34-32-,43-40-,55-51-/t59-/m1/s1 Image of MNXM1019612
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:32]=[CH:34]\[CH2:37]/[CH:40]=[CH:43]\[CH2:46][CH2:49][CH2:52][C:60](=[N:62][CH2:54][CH2:56][O:68][P:71]([OH:65])(=[O:66])[O:69][CH2:58][C@@H:59]([CH2:57][O:67]/[CH:55]=[CH:51]\[CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:29][CH2:26]/[CH:23]=[CH:20]\[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[O:70][C:61]([CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35]/[CH:31]=[CH:27]\[CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:64])[OH:63]
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:000712001
slm:000712001
ZQVWKJYTRBHNMS-DIRIQAJTSA-M
1-O-(1Z,11Z-octadecadienyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-ethanolamine
N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-1-O-(1Z,11Z-octadecadienyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (P-18:1(11Z)/18:1(9Z)/20:4(5Z,8Z,11Z,14Z))