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1-(10Z,13Z,16Z-docosatrienoyl)-2-(19Z,22Z,25Z,28Z-tetratriacontatetraenoyl)-sn-glycero-3-phospho-N-(9Z-octadecenoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM958304 Image of MNXM958304
referenceslm:000650689
formulaC79H139NO9P
global charge-1
mol weight1277.953
InChIKeyPJZCCUXUVPTGMP-KWMPDLPXSA-M
InChIInChI=1S/C79H140NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-35-36-37-38-39-40-41-42-43-45-47-50-53-56-59-62-65-68-71-79(83)89-76(74-86-78(82)70-67-64-61-58-55-52-49-46-44-31-29-26-23-20-17-14-11-8-5-2)75-88-90(84,85)87-73-72-80-77(81)69-66-63-60-57-54-51-48-27-24-21-18-15-12-9-6-3/h16-17,19-20,25-29,32-33,35-36,44,46,48,76H,4-15,18,21-24,30-31,34,37-43,45,47,49-75H2,1-3H3,(H,80,81)(H,84,85)/p-1/b19-16-,20-17-,28-25-,29-26-,33-32-,36-35-,46-44-,48-27-/t76-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCC/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C79H140NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-35-36-37-38-39-40-41-42-43-45-47-50-53-56-59-62-65-68-71-79(83)89-76(74-86-78(82)70-67-64-61-58-55-52-49-46-44-31-29-26-23-20-17-14-11-8-5-2)75-88-90(84,85)87-73-72-80-77(81)69-66-63-60-57-54-51-48-27-24-21-18-15-12-9-6-3/h16-17,19-20,25-29,32-33,35-36,44,46,48,76H,4-15,18,21-24,30-31,34,37-43,45,47,49-75H2,1-3H3,(H,80,81)(H,84,85)/b19-16-,20-17-,28-25-,29-26-,33-32-,36-35-,46-44-,48-27-/t76-/m1/s1 Image of MNXM958304
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:33]\[CH2:34]/[CH:35]=[CH:36]\[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:45][CH2:47][CH2:50][CH2:53][CH2:56][CH2:59][CH2:62][CH2:65][CH2:68][CH2:71][C:79](=[O:83])[O:89][C@H:76]([CH2:74][O:86][C:78]([CH2:70][CH2:67][CH2:64][CH2:61][CH2:58][CH2:55][CH2:52][CH2:49]/[CH:46]=[CH:44]\[CH2:31]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:82])[CH2:75][O:88][P:90]([OH:84])(=[O:85])[O:87][CH2:73][CH2:72][N:80]=[C:77]([CH2:69][CH2:66][CH2:63][CH2:60][CH2:57][CH2:54][CH2:51]/[CH:48]=[CH:27]\[CH2:24][CH2:21][CH2:18][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:000650689
slm:000650689
PJZCCUXUVPTGMP-KWMPDLPXSA-M 		1-(10Z,13Z,16Z-docosatrienoyl)-2-(19Z,22Z,25Z,28Z-tetratriacontatetraenoyl)-sn-glycero-3-phospho-N-(9Z-octadecenoyl)-ethanolamine
N-(9Z-octadecenoyl)-1-(10Z,13Z,16Z-docosatrienoyl)-2-(19Z,22Z,25Z,28Z-tetratriacontatetraenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (22:3(10Z,13Z,16Z)/34:4(19Z,22Z,25Z,28Z)/18:1(9Z))