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1-O-tetracosyl-2-(21Z,24Z,27Z,30Z-hexatriacontatetraenoyl)-sn-glycero-3-phospho-N-hexanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM1035911 Image of MNXM1035911
referenceslm:000728300
formulaC71H133NO8P
global charge-1
mol weight1159.818
InChIKeyRQTJUYZYSUAZEA-BFJWKFLRSA-M
InChIInChI=1S/C71H134NO8P/c1-4-7-10-12-14-16-18-20-22-24-26-28-30-31-32-33-34-35-36-37-38-39-40-41-43-45-47-49-51-53-55-57-60-63-71(74)80-69(68-79-81(75,76)78-66-64-72-70(73)62-59-9-6-3)67-77-65-61-58-56-54-52-50-48-46-44-42-29-27-25-23-21-19-17-15-13-11-8-5-2/h14,16,20,22,26,28,31-32,69H,4-13,15,17-19,21,23-25,27,29-30,33-68H2,1-3H3,(H,72,73)(H,75,76)/p-1/b16-14-,22-20-,28-26-,32-31-/t69-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCCCCCCCC)COP(=O)([O-])OCCNC(=O)CCCCC
MNX internals
InChI (mnx)InChI=1/C71H134NO8P/c1-4-7-10-12-14-16-18-20-22-24-26-28-30-31-32-33-34-35-36-37-38-39-40-41-43-45-47-49-51-53-55-57-60-63-71(74)80-69(68-79-81(75,76)78-66-64-72-70(73)62-59-9-6-3)67-77-65-61-58-56-54-52-50-48-46-44-42-29-27-25-23-21-19-17-15-13-11-8-5-2/h14,16,20,22,26,28,31-32,69H,4-13,15,17-19,21,23-25,27,29-30,33-68H2,1-3H3,(H,72,73)(H,75,76)/b16-14-,22-20-,28-26-,32-31-/t69-/m1/s1 Image of MNXM1035911
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:24]/[CH:26]=[CH:28]\[CH2:30]/[CH:31]=[CH:32]\[CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:43][CH2:45][CH2:47][CH2:49][CH2:51][CH2:53][CH2:55][CH2:57][CH2:60][CH2:63][C:71](=[O:74])[O:80][C@H:69]([CH2:67][O:77][CH2:65][CH2:61][CH2:58][CH2:56][CH2:54][CH2:52][CH2:50][CH2:48][CH2:46][CH2:44][CH2:42][CH2:29][CH2:27][CH2:25][CH2:23][CH2:21][CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:8][CH2:5][CH3:2])[CH2:68][O:79][P:81]([OH:75])(=[O:76])[O:78][CH2:66][CH2:64][N:72]=[C:70]([CH2:62][CH2:59][CH2:9][CH2:6][CH3:3])[OH:73]
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:000728300
slm:000728300
RQTJUYZYSUAZEA-BFJWKFLRSA-M
1-O-tetracosyl-2-(21Z,24Z,27Z,30Z-hexatriacontatetraenoyl)-sn-glycero-3-phospho-N-hexanoyl-ethanolamine
N-hexanoyl-1-O-tetracosyl-2-(21Z,24Z,27Z,30Z-hexatriacontatetraenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (O-24:0/36:4(21Z,24Z,27Z,30Z)/6:0)