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

PropertiesImage
MNX_IDMNXM1043538 Image of MNXM1043538
referenceslm:000735927
formulaC65H119NO8P
global charge-1
mol weight1073.64
InChIKeyMTMPGVMXFYFHBU-UHCZACFDSA-M
InChIInChI=1S/C65H120NO8P/c1-4-7-10-13-16-19-22-25-28-30-31-32-34-37-40-43-46-49-52-55-59-71-61-63(74-65(68)57-54-51-48-45-42-39-35-27-24-21-18-15-12-9-6-3)62-73-75(69,70)72-60-58-66-64(67)56-53-50-47-44-41-38-36-33-29-26-23-20-17-14-11-8-5-2/h17,20,25-26,28-29,36,38,44,47,63H,4-16,18-19,21-24,27,30-35,37,39-43,45-46,48-62H2,1-3H3,(H,66,67)(H,69,70)/p-1/b20-17-,28-25-,29-26-,38-36-,47-44-/t63-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCOP(=O)([O-])OC[C@@H](COCCCCCCCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C65H120NO8P/c1-4-7-10-13-16-19-22-25-28-30-31-32-34-37-40-43-46-49-52-55-59-71-61-63(74-65(68)57-54-51-48-45-42-39-35-27-24-21-18-15-12-9-6-3)62-73-75(69,70)72-60-58-66-64(67)56-53-50-47-44-41-38-36-33-29-26-23-20-17-14-11-8-5-2/h17,20,25-26,28-29,36,38,44,47,63H,4-16,18-19,21-24,27,30-35,37,39-43,45-46,48-62H2,1-3H3,(H,66,67)(H,69,70)/b20-17-,28-25-,29-26-,38-36-,47-44-/t63-/m1/s1 Image of MNXM1043538
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22]/[CH:25]=[CH:28]\[CH2:30][CH2:31][CH2:32][CH2:34][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]/[CH:47]=[CH:44]\[CH2:41]/[CH:38]=[CH:36]\[CH2:33]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH:67])[O:74][C:65]([CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:35][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[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:000735927
slm:000735927
MTMPGVMXFYFHBU-UHCZACFDSA-M
1-O-(13Z-docosenyl)-2-octadecanoyl-sn-glycero-3-phospho-N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-ethanolamine
N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-1-O-(13Z-docosenyl)-2-octadecanoyl-sn-glycero-3-phosphoethanolamine
NAPE (O-22:1(13Z)/18:0/20:4(5Z,8Z,11Z,14Z))