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1-O-octadecyl-2-(15Z-tetracosenoyl)-sn-glycero-3-phospho-N-decanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM1032581 Image of MNXM1032581
referenceslm:000724970
formulaC57H111NO8P
global charge-1
mol weight969.488
InChIKeyLFVSYAHWVWEQGT-KTVVXTIISA-M
InChIInChI=1S/C57H112NO8P/c1-4-7-10-13-16-18-20-22-24-26-27-28-29-30-31-33-35-37-40-43-46-49-57(60)66-55(53-63-51-47-44-41-38-36-34-32-25-23-21-19-17-14-11-8-5-2)54-65-67(61,62)64-52-50-58-56(59)48-45-42-39-15-12-9-6-3/h22,24,55H,4-21,23,25-54H2,1-3H3,(H,58,59)(H,61,62)/p-1/b24-22-/t55-/m1/s1
SMILESCCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C57H112NO8P/c1-4-7-10-13-16-18-20-22-24-26-27-28-29-30-31-33-35-37-40-43-46-49-57(60)66-55(53-63-51-47-44-41-38-36-34-32-25-23-21-19-17-14-11-8-5-2)54-65-67(61,62)64-52-50-58-56(59)48-45-42-39-15-12-9-6-3/h22,24,55H,4-21,23,25-54H2,1-3H3,(H,58,59)(H,61,62)/b24-22-/t55-/m1/s1 Image of MNXM1032581
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:18][CH2:20]/[CH:22]=[CH:24]\[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:33][CH2:35][CH2:37][CH2:40][CH2:43][CH2:46][CH2:49][C:57](=[O:60])[O:66][C@H:55]([CH2:53][O:63][CH2:51][CH2:47][CH2:44][CH2:41][CH2:38][CH2:36][CH2:34][CH2:32][CH2:25][CH2:23][CH2:21][CH2:19][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[CH2:54][O:65][P:67]([OH:61])(=[O:62])[O:64][CH2:52][CH2:50][N:58]=[C:56]([CH2:48][CH2:45][CH2:42][CH2:39][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:000724970
slm:000724970
LFVSYAHWVWEQGT-KTVVXTIISA-M
1-O-octadecyl-2-(15Z-tetracosenoyl)-sn-glycero-3-phospho-N-decanoyl-ethanolamine
N-decanoyl-1-O-octadecyl-2-(15Z-tetracosenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (O-18:0/24:1(15Z)/10:0)