6-(1-azanyl-15-methyl-1-oxidanylidene-hexadecan-3-yl)oxy-5-[(15-methyl-3-oxidanyl-hexadecanoyl)amino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(1-azanyl-15-methyl-1-oxidanylidene-hexadecan-3-yl)oxy-5-[(15-methyl-3-oxidanyl-hexadecanoyl)amino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[1-(2-amino-2-oxo-ethyl)-13-methyl-tetradecoxy]-5-[(3-hydroxy-15-methyl-hexadecanoyl)amino]-6-oxo-hexanoic acid CAS Name: 6-(1-amino-15-methyl-1-oxohexadecan-3-yl)oxy-5-[(3-hydroxy-15-methyl-1-oxohexadecyl)amino]-6-oxohexanoic acid IUPAC Name: 6-(1-amino-15-methyl-1-oxohexadecan-3-yl)oxy-5-[(3-hydroxy-15-methylhexadecanoyl)amino]-6-oxohexanoic acid Traditional Name: 6-[1-(2-amino-2-keto-ethyl)-13-methyl-tetradecoxy]-5-[(3-hydroxy-15-methyl-hexadecanoyl)amino]-6-keto-hexanoic acid Formula: C40H76N2O7 MolecularWeight: 697.04064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCC(CC(=O)NC(CCCC(=O)O)C(=O)OC(CCCCCCCCCCCC(C)C)CC(=O)N)O

Isomeric SMILES

CC(C)CCCCCCCCCCCC(CC(=O)NC(CCCC(=O)O)C(=O)OC(CCCCCCCCCCCC(C)C)CC(=O)N)O

InChI

InChI=1S/C40H76N2O7/c1-32(2)24-19-15-11-7-5-9-13-17-21-26-34(43)30-38(45)42-36(28-23-29-39(46)47)40(48)49-35(31-37(41)44)27-22-18-14-10-6-8-12-16-20-25-33(3)4/h32-36,43H,5-31H2,1-4H3,(H2,41,44)(H,42,45)(H,46,47)