2-[6-azanyl-2-[(14-methyl-3-oxidanyl-pentadecanoyl)amino]hexanoyl]oxyethyl 13-methyl-2-oxidanyl-tetradecanoate

Systemtic Name: 2-[6-azanyl-2-[(14-methyl-3-oxidanyl-pentadecanoyl)amino]hexanoyl]oxyethyl 13-methyl-2-oxidanyl-tetradecanoate Openeye Name: 2-[6-amino-2-[(3-hydroxy-14-methyl-pentadecanoyl)amino]hexanoyl]oxyethyl 2-hydroxy-13-methyl-tetradecanoate CAS Name: 2-hydroxy-13-methyltetradecanoic acid 2-[6-amino-2-[(3-hydroxy-14-methyl-1-oxopentadecyl)amino]-1-oxohexoxy]ethyl ester IUPAC Name: 2-[6-amino-2-[(3-hydroxy-14-methylpentadecanoyl)amino]hexanoyl]oxyethyl 2-hydroxy-13-methyltetradecanoate Traditional Name: 2-hydroxy-13-methyl-myristic acid 2-[6-amino-2-[(3-hydroxy-14-methyl-pentadecanoyl)amino]hexanoyl]oxyethyl ester Formula: C39H76N2O7 MolecularWeight: 685.02994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCC(CC(=O)NC(CCCCN)C(=O)OCCOC(=O)C(CCCCCCCCCCC(C)C)O)O

Isomeric SMILES

CC(C)CCCCCCCCCCC(CC(=O)NC(CCCCN)C(=O)OCCOC(=O)C(CCCCCCCCCCC(C)C)O)O

InChI

InChI=1S/C39H76N2O7/c1-32(2)23-17-13-9-5-7-11-15-19-25-34(42)31-37(44)41-35(26-21-22-28-40)38(45)47-29-30-48-39(46)36(43)27-20-16-12-8-6-10-14-18-24-33(3)4/h32-36,42-43H,5-31,40H2,1-4H3,(H,41,44)