Search MNXref
 Feedback

1-O-tetracosyl-2-octadecanoyl-sn-glycero-3-phospho-N-octanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM1035296 Image of MNXM1035296
referenceslm:000727685
formulaC55H109NO8P
global charge-1
mol weight943.45
InChIKeyRKGMFYUYJVRXLM-IONAWPRUSA-M
InChIInChI=1S/C55H110NO8P/c1-4-7-10-13-15-17-19-21-23-24-25-26-27-28-29-31-33-35-37-39-42-45-49-61-51-53(52-63-65(59,60)62-50-48-56-54(57)46-43-40-12-9-6-3)64-55(58)47-44-41-38-36-34-32-30-22-20-18-16-14-11-8-5-2/h53H,4-52H2,1-3H3,(H,56,57)(H,59,60)/p-1/t53-/m1/s1
SMILESCCCCCCCCCCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C55H110NO8P/c1-4-7-10-13-15-17-19-21-23-24-25-26-27-28-29-31-33-35-37-39-42-45-49-61-51-53(52-63-65(59,60)62-50-48-56-54(57)46-43-40-12-9-6-3)64-55(58)47-44-41-38-36-34-32-30-22-20-18-16-14-11-8-5-2/h53H,4-52H2,1-3H3,(H,56,57)(H,59,60)/t53-/m1/s1 Image of MNXM1035296
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:42][CH2:45][CH2:49][O:61][CH2:51][C@H:53]([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][CH2:12][CH2:9][CH2:6][CH3:3])[OH:57])[O:64][C:55]([CH2:47][CH2:44][CH2:41][CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:58]
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:000727685
slm:000727685
RKGMFYUYJVRXLM-IONAWPRUSA-M
1-O-tetracosyl-2-octadecanoyl-sn-glycero-3-phospho-N-octanoyl-ethanolamine
N-octanoyl-1-O-tetracosyl-2-octadecanoyl-sn-glycero-3-phosphoethanolamine
NAPE (O-24:0/18:0/8:0)