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1-O-tetradecyl-2-(23Z,26Z,29Z,32Z,35Z-octatriacontapentaenoyl)-sn-glycero-3-phospho-N-octadecanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM1027349 Image of MNXM1027349
referenceslm:000719738
formulaC75H139NO8P
global charge-1
mol weight1213.91
InChIKeyTVLQOIJAISYPRN-AROOXWRKSA-M
InChIInChI=1S/C75H140NO8P/c1-4-7-10-13-16-19-22-25-27-28-29-30-31-32-33-34-35-36-37-38-39-40-41-42-43-44-45-46-48-50-52-55-58-61-64-67-75(78)84-73(71-81-69-65-62-59-56-53-24-21-18-15-12-9-6-3)72-83-85(79,80)82-70-68-76-74(77)66-63-60-57-54-51-49-47-26-23-20-17-14-11-8-5-2/h7,10,16,19,25,27,29-30,32-33,73H,4-6,8-9,11-15,17-18,20-24,26,28,31,34-72H2,1-3H3,(H,76,77)(H,79,80)/p-1/b10-7-,19-16-,27-25-,30-29-,33-32-/t73-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C75H140NO8P/c1-4-7-10-13-16-19-22-25-27-28-29-30-31-32-33-34-35-36-37-38-39-40-41-42-43-44-45-46-48-50-52-55-58-61-64-67-75(78)84-73(71-81-69-65-62-59-56-53-24-21-18-15-12-9-6-3)72-83-85(79,80)82-70-68-76-74(77)66-63-60-57-54-51-49-47-26-23-20-17-14-11-8-5-2/h7,10,16,19,25,27,29-30,32-33,73H,4-6,8-9,11-15,17-18,20-24,26,28,31,34-72H2,1-3H3,(H,76,77)(H,79,80)/b10-7-,19-16-,27-25-,30-29-,33-32-/t73-/m1/s1 Image of MNXM1027349
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:27]\[CH2:28]/[CH:29]=[CH:30]\[CH2:31]/[CH:32]=[CH:33]\[CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:48][CH2:50][CH2:52][CH2:55][CH2:58][CH2:61][CH2:64][CH2:67][C:75](=[O:78])[O:84][C@H:73]([CH2:71][O:81][CH2:69][CH2:65][CH2:62][CH2:59][CH2:56][CH2:53][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[CH2:72][O:83][P:85]([OH:79])(=[O:80])[O:82][CH2:70][CH2:68][N:76]=[C:74]([CH2:66][CH2:63][CH2:60][CH2:57][CH2:54][CH2:51][CH2:49][CH2:47][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH:77]
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:000719738
slm:000719738
TVLQOIJAISYPRN-AROOXWRKSA-M
1-O-tetradecyl-2-(23Z,26Z,29Z,32Z,35Z-octatriacontapentaenoyl)-sn-glycero-3-phospho-N-octadecanoyl-ethanolamine
N-octadecanoyl-1-O-tetradecyl-2-(23Z,26Z,29Z,32Z,35Z-octatriacontapentaenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (O-14:0/38:5(23Z,26Z,29Z,32Z,35Z)/18:0)