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1-O-(9Z-octadecenyl)-2-(23Z,26Z,29Z,32Z,35Z-octatriacontapentaenoyl)-sn-glycero-3-phospho-N-(6Z,9Z,12Z-octadecatrienoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM1041465 Image of MNXM1041465
referenceslm:000733854
formulaC79H139NO8P
global charge-1
mol weight1261.954
InChIKeyMEOBOYFVHLOZPQ-AQJCVHRESA-M
InChIInChI=1S/C79H140NO8P/c1-4-7-10-13-16-19-22-25-28-30-31-32-33-34-35-36-37-38-39-40-41-42-43-44-45-46-47-48-50-53-56-59-62-65-68-71-79(82)88-77(75-85-73-69-66-63-60-57-54-51-29-26-23-20-17-14-11-8-5-2)76-87-89(83,84)86-74-72-80-78(81)70-67-64-61-58-55-52-49-27-24-21-18-15-12-9-6-3/h7,10,16,18-19,21,25-29,31-32,34-35,49,55,58,77H,4-6,8-9,11-15,17,20,22-24,30,33,36-48,50-54,56-57,59-76H2,1-3H3,(H,80,81)(H,83,84)/p-1/b10-7-,19-16-,21-18-,28-25-,29-26-,32-31-,35-34-,49-27-,58-55-/t77-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COCCCCCCCC/C=C\CCCCCCCC)COP(=O)([O-])OCCNC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C79H140NO8P/c1-4-7-10-13-16-19-22-25-28-30-31-32-33-34-35-36-37-38-39-40-41-42-43-44-45-46-47-48-50-53-56-59-62-65-68-71-79(82)88-77(75-85-73-69-66-63-60-57-54-51-29-26-23-20-17-14-11-8-5-2)76-87-89(83,84)86-74-72-80-78(81)70-67-64-61-58-55-52-49-27-24-21-18-15-12-9-6-3/h7,10,16,18-19,21,25-29,31-32,34-35,49,55,58,77H,4-6,8-9,11-15,17,20,22-24,30,33,36-48,50-54,56-57,59-76H2,1-3H3,(H,80,81)(H,83,84)/b10-7-,19-16-,21-18-,28-25-,29-26-,32-31-,35-34-,49-27-,58-55-/t77-/m1/s1 Image of MNXM1041465
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:31]=[CH:32]\[CH2:33]/[CH:34]=[CH:35]\[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:50][CH2:53][CH2:56][CH2:59][CH2:62][CH2:65][CH2:68][CH2:71][C:79](=[O:82])[O:88][C@H:77]([CH2:75][O:85][CH2:73][CH2:69][CH2:66][CH2:63][CH2:60][CH2:57][CH2:54][CH2:51]/[CH:29]=[CH:26]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[CH2:76][O:87][P:89]([OH:83])(=[O:84])[O:86][CH2:74][CH2:72][N:80]=[C:78]([CH2:70][CH2:67][CH2:64][CH2:61]/[CH:58]=[CH:55]\[CH2:52]/[CH:49]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:81]
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:000733854
slm:000733854
MEOBOYFVHLOZPQ-AQJCVHRESA-M 		1-O-(9Z-octadecenyl)-2-(23Z,26Z,29Z,32Z,35Z-octatriacontapentaenoyl)-sn-glycero-3-phospho-N-(6Z,9Z,12Z-octadecatrienoyl)-ethanolamine
N-(6Z,9Z,12Z-octadecatrienoyl)-1-O-(9Z-octadecenyl)-2-(23Z,26Z,29Z,32Z,35Z-octatriacontapentaenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (O-18:1(9Z)/38:5(23Z,26Z,29Z,32Z,35Z)/18:3(6Z,9Z,12Z))