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1-(6Z,9Z,12Z-octadecatrienoyl)-2-(15Z-tetracosenoyl)-sn-glycero-3-phospho-N-decanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM956151 Image of MNXM956151
referenceslm:000648536
formulaC57H103NO9P
global charge-1
mol weight977.423
InChIKeyLSLFQUDDASCURN-MZCUHSLBSA-M
InChIInChI=1S/C57H104NO9P/c1-4-7-10-13-16-18-20-22-24-25-26-27-28-29-31-33-35-37-40-43-46-49-57(61)67-54(53-66-68(62,63)65-51-50-58-55(59)47-44-41-38-15-12-9-6-3)52-64-56(60)48-45-42-39-36-34-32-30-23-21-19-17-14-11-8-5-2/h17,19,22-24,30,34,36,54H,4-16,18,20-21,25-29,31-33,35,37-53H2,1-3H3,(H,58,59)(H,62,63)/p-1/b19-17-,24-22-,30-23-,36-34-/t54-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCC)OC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C57H104NO9P/c1-4-7-10-13-16-18-20-22-24-25-26-27-28-29-31-33-35-37-40-43-46-49-57(61)67-54(53-66-68(62,63)65-51-50-58-55(59)47-44-41-38-15-12-9-6-3)52-64-56(60)48-45-42-39-36-34-32-30-23-21-19-17-14-11-8-5-2/h17,19,22-24,30,34,36,54H,4-16,18,20-21,25-29,31-33,35,37-53H2,1-3H3,(H,58,59)(H,62,63)/b19-17-,24-22-,30-23-,36-34-/t54-/m1/s1 Image of MNXM956151
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:18][CH2:20]/[CH:22]=[CH:24]\[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:40][CH2:43][CH2:46][CH2:49][C:57](=[O:61])[O:67][C@H:54]([CH2:52][O:64][C:56]([CH2:48][CH2:45][CH2:42][CH2:39]/[CH:36]=[CH:34]\[CH2:32]/[CH:30]=[CH:23]\[CH2:21]/[CH:19]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:60])[CH2:53][O:66][P:68]([OH:62])(=[O:63])[O:65][CH2:51][CH2:50][N:58]=[C:55]([CH2:47][CH2:44][CH2:41][CH2:38][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:59]
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:000648536
slm:000648536
LSLFQUDDASCURN-MZCUHSLBSA-M
1-(6Z,9Z,12Z-octadecatrienoyl)-2-(15Z-tetracosenoyl)-sn-glycero-3-phospho-N-decanoyl-ethanolamine
N-decanoyl-1-(6Z,9Z,12Z-octadecatrienoyl)-2-(15Z-tetracosenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (18:3(6Z,9Z,12Z)/24:1(15Z)/10:0)