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1-O-tetradecyl-2-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycero-3-phospho-N-hexadecanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM1027544 Image of MNXM1027544
referenceslm:000719933
formulaC55H103NO8P
global charge-1
mol weight937.402
InChIKeyUAOKVVFNUHENHL-RQAPHXOFSA-M
InChIInChI=1S/C55H104NO8P/c1-4-7-10-13-16-19-22-25-26-27-28-30-32-35-38-41-44-47-55(58)64-53(51-61-49-45-42-39-36-33-24-21-18-15-12-9-6-3)52-63-65(59,60)62-50-48-56-54(57)46-43-40-37-34-31-29-23-20-17-14-11-8-5-2/h16,19,25-26,28,30,53H,4-15,17-18,20-24,27,29,31-52H2,1-3H3,(H,56,57)(H,59,60)/p-1/b19-16-,26-25-,30-28-/t53-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C55H104NO8P/c1-4-7-10-13-16-19-22-25-26-27-28-30-32-35-38-41-44-47-55(58)64-53(51-61-49-45-42-39-36-33-24-21-18-15-12-9-6-3)52-63-65(59,60)62-50-48-56-54(57)46-43-40-37-34-31-29-23-20-17-14-11-8-5-2/h16,19,25-26,28,30,53H,4-15,17-18,20-24,27,29,31-52H2,1-3H3,(H,56,57)(H,59,60)/b19-16-,26-25-,30-28-/t53-/m1/s1 Image of MNXM1027544
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:26]\[CH2:27]/[CH:28]=[CH:30]\[CH2:32][CH2:35][CH2:38][CH2:41][CH2:44][CH2:47][C:55](=[O:58])[O:64][C@H:53]([CH2:51][O:61][CH2:49][CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[CH2:52][O:63][P:65]([OH:59])(=[O:60])[O:62][CH2:50][CH2:48][N:56]=[C:54]([CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:29][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH:57]
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:000719933
slm:000719933
UAOKVVFNUHENHL-RQAPHXOFSA-M
1-O-tetradecyl-2-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycero-3-phospho-N-hexadecanoyl-ethanolamine
N-hexadecanoyl-1-O-tetradecyl-2-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycero-3-phosphoethanolamine
NAPE (O-14:0/20:3(8Z,11Z,14Z)/16:0)