5-[ethanoyl(1H-imidazol-5-yl)amino]-6-oxidanylidene-6-(16-oxidanylidenehexadecanoylamino)hexanoic acid

Systemtic Name: 5-[ethanoyl(1H-imidazol-5-yl)amino]-6-oxidanylidene-6-(16-oxidanylidenehexadecanoylamino)hexanoic acid Openeye Name: 5-[acetyl(1H-imidazol-5-yl)amino]-6-oxo-6-(16-oxohexadecanoylamino)hexanoic acid CAS Name: 5-[acetyl(1H-imidazol-5-yl)amino]-6-(1,16-dioxohexadecylamino)-6-oxohexanoic acid IUPAC Name: 5-[acetyl(1H-imidazol-5-yl)amino]-6-oxo-6-(16-oxohexadecanoylamino)hexanoic acid Traditional Name: 5-[acetyl(1H-imidazol-5-yl)amino]-6-keto-6-(16-ketohexadecanoylamino)hexanoic acid Formula: C27H44N4O6 MolecularWeight: 520.66146

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CN=CN1)C(CCCC(=O)O)C(=O)NC(=O)CCCCCCCCCCCCCCC=O

Isomeric SMILES

CC(=O)N(C1=CN=CN1)C(CCCC(=O)O)C(=O)NC(=O)CCCCCCCCCCCCCCC=O

InChI

InChI=1S/C27H44N4O6/c1-22(33)31(24-20-28-21-29-24)23(16-15-18-26(35)36)27(37)30-25(34)17-13-11-9-7-5-3-2-4-6-8-10-12-14-19-32/h19-21,23H,2-18H2,1H3,(H,28,29)(H,35,36)(H,30,34,37)