(4S)-4-azanyl-5-[(3,5-dimethyl-1-adamantyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-4-azanyl-5-[(3,5-dimethyl-1-adamantyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-4-amino-5-[(3,5-dimethyl-1-adamantyl)amino]-5-oxo-pentanoic acid CAS Name: (4S)-4-amino-5-[(3,5-dimethyl-1-adamantyl)amino]-5-oxopentanoic acid IUPAC Name: (4S)-4-amino-5-[(3,5-dimethyl-1-adamantyl)amino]-5-oxopentanoic acid Traditional Name: (4S)-4-amino-5-[(3,5-dimethyl-1-adamantyl)amino]-5-keto-valeric acid Formula: C17H28N2O3 MolecularWeight: 308.41582

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)NC(=O)C(CCC(=O)O)N)C

Isomeric SMILES

CC12CC3CC(C1)(CC(C3)(C2)NC(=O)[C@H](CCC(=O)O)N)C

InChI

InChI=1S/C17H28N2O3/c1-15-5-11-6-16(2,8-15)10-17(7-11,9-15)19-14(22)12(18)3-4-13(20)21/h11-12H,3-10,18H2,1-2H3,(H,19,22)(H,20,21)/t11?,12-,15?,16?,17?/m0/s1