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1-O-docosyl-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-sn-glycero-3-phospho-N-hexadecanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM1034768 Image of MNXM1034768
referenceslm:000727157
formulaC65H119NO8P
global charge-1
mol weight1073.64
InChIKeyMLPFADWVDMXJAL-RFXNNCFHSA-M
InChIInChI=1S/C65H120NO8P/c1-4-7-10-13-16-19-22-25-27-29-31-33-35-37-40-43-46-49-52-55-59-71-61-63(74-65(68)57-54-51-48-45-42-39-36-34-32-30-28-26-23-20-17-14-11-8-5-2)62-73-75(69,70)72-60-58-66-64(67)56-53-50-47-44-41-38-24-21-18-15-12-9-6-3/h17,20,26,28,32,34,39,42,48,51,63H,4-16,18-19,21-25,27,29-31,33,35-38,40-41,43-47,49-50,52-62H2,1-3H3,(H,66,67)(H,69,70)/p-1/b20-17-,28-26-,34-32-,42-39-,51-48-/t63-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCCCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C65H120NO8P/c1-4-7-10-13-16-19-22-25-27-29-31-33-35-37-40-43-46-49-52-55-59-71-61-63(74-65(68)57-54-51-48-45-42-39-36-34-32-30-28-26-23-20-17-14-11-8-5-2)62-73-75(69,70)72-60-58-66-64(67)56-53-50-47-44-41-38-24-21-18-15-12-9-6-3/h17,20,26,28,32,34,39,42,48,51,63H,4-16,18-19,21-25,27,29-31,33,35-38,40-41,43-47,49-50,52-62H2,1-3H3,(H,66,67)(H,69,70)/b20-17-,28-26-,34-32-,42-39-,51-48-/t63-/m1/s1 Image of MNXM1034768
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:40][CH2:43][CH2:46][CH2:49][CH2:52][CH2:55][CH2:59][O:71][CH2:61][C@H:63]([CH2:62][O:73][P:75]([OH:69])(=[O:70])[O:72][CH2:60][CH2:58][N:66]=[C:64]([CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:67])[O:74][C:65]([CH2:57][CH2:54]/[CH:51]=[CH:48]\[CH2:45]/[CH:42]=[CH:39]\[CH2:36]/[CH:34]=[CH:32]\[CH2:30]/[CH:28]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:68]
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:000727157
slm:000727157
MLPFADWVDMXJAL-RFXNNCFHSA-M
1-O-docosyl-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-sn-glycero-3-phospho-N-hexadecanoyl-ethanolamine
N-hexadecanoyl-1-O-docosyl-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (O-22:0/22:5(4Z,7Z,10Z,13Z,16Z)/16:0)