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1-O-(11-methyldodecyl)-2-heptadecanoyl-sn-glycero-3-phospho-N-octanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM1026826 Image of MNXM1026826
referenceslm:000719215
formulaC43H85NO8P
global charge-1
mol weight775.126
InChIKeyRBHQCRDFAFRFHC-VQJSHJPSSA-M
InChIInChI=1S/C43H86NO8P/c1-5-7-9-11-12-13-14-15-16-17-18-22-26-30-34-43(46)52-41(38-49-36-31-27-23-20-19-21-25-28-32-40(3)4)39-51-53(47,48)50-37-35-44-42(45)33-29-24-10-8-6-2/h40-41H,5-39H2,1-4H3,(H,44,45)(H,47,48)/p-1/t41-/m1/s1
SMILESCCCCCCCCCCCCCCCCC(=O)O[C@H](COCCCCCCCCCCC(C)C)COP(=O)([O-])OCCNC(=O)CCCCCCC
MNX internals
InChI (mnx)InChI=1/C43H86NO8P/c1-5-7-9-11-12-13-14-15-16-17-18-22-26-30-34-43(46)52-41(38-49-36-31-27-23-20-19-21-25-28-32-40(3)4)39-51-53(47,48)50-37-35-44-42(45)33-29-24-10-8-6-2/h40-41H,5-39H2,1-4H3,(H,44,45)(H,47,48)/t41-/m1/s1 Image of MNXM1026826
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:22][CH2:26][CH2:30][CH2:34][C:43](=[O:46])[O:52][C@H:41]([CH2:38][O:49][CH2:36][CH2:31][CH2:27][CH2:23][CH2:20][CH2:19][CH2:21][CH2:25][CH2:28][CH2:32][CH:40]([CH3:3])[CH3:4])[CH2:39][O:51][P:53]([OH:47])(=[O:48])[O:50][CH2:37][CH2:35][N:44]=[C:42]([CH2:33][CH2:29][CH2:24][CH2:10][CH2:8][CH2:6][CH3:2])[OH:45]
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:000719215
slm:000719215
RBHQCRDFAFRFHC-VQJSHJPSSA-M
1-O-(11-methyldodecyl)-2-heptadecanoyl-sn-glycero-3-phospho-N-octanoyl-ethanolamine
N-octanoyl-1-O-(11-methyldodecyl)-2-heptadecanoyl-sn-glycero-3-phosphoethanolamine
NAPE (O-13:0(11-me)/17:0/8:0)