(4S,5S)-2,7-dimethyl-N-(3-methylbutyl)-5-[[3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]-4-oxidanyl-octanamide

Systemtic Name: (4S,5S)-2,7-dimethyl-N-(3-methylbutyl)-5-[[3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]-4-oxidanyl-octanamide Openeye Name: (4S,5S)-4-hydroxy-N-isopentyl-2,7-dimethyl-5-[[3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]octanamide CAS Name: (4S,5S)-4-hydroxy-2,7-dimethyl-N-(3-methylbutyl)-5-[[3-methyl-2-[(3-methyl-1-oxobutyl)amino]-1-oxobutyl]amino]octanamide IUPAC Name: (4S,5S)-4-hydroxy-2,7-dimethyl-N-(3-methylbutyl)-5-[[3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]octanamide Traditional Name: (4S,5S)-4-hydroxy-N-isoamyl-5-[[2-(isovalerylamino)-3-methyl-butanoyl]amino]-2,7-dimethyl-caprylamide Formula: C25H49N3O4 MolecularWeight: 455.67426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C(C)CC(C(CC(C)C)NC(=O)C(C(C)C)NC(=O)CC(C)C)O

Isomeric SMILES

CC(C)CCNC(=O)C(C)C[C@@H]([C@H](CC(C)C)NC(=O)C(C(C)C)NC(=O)CC(C)C)O

InChI

InChI=1S/C25H49N3O4/c1-15(2)10-11-26-24(31)19(9)14-21(29)20(12-16(3)4)27-25(32)23(18(7)8)28-22(30)13-17(5)6/h15-21,23,29H,10-14H2,1-9H3,(H,26,31)(H,27,32)(H,28,30)/t19?,20-,21-,23?/m0/s1