(3S,4S,5R)-1-[(3,5-dimethyl-1-adamantyl)amino]-3,4,5,6-tetrakis(oxidanyl)hexan-2-one

Systemtic Name: (3S,4S,5R)-1-[(3,5-dimethyl-1-adamantyl)amino]-3,4,5,6-tetrakis(oxidanyl)hexan-2-one Openeye Name: (3S,4S,5R)-1-[(3,5-dimethyl-1-adamantyl)amino]-3,4,5,6-tetrahydroxy-hexan-2-one CAS Name: (3S,4S,5R)-1-[(3,5-dimethyl-1-adamantyl)amino]-3,4,5,6-tetrahydroxy-2-hexanone IUPAC Name: (3S,4S,5R)-1-[(3,5-dimethyl-1-adamantyl)amino]-3,4,5,6-tetrahydroxyhexan-2-one Traditional Name: (3S,4S,5R)-1-[(3,5-dimethyl-1-adamantyl)amino]-3,4,5,6-tetrahydroxy-hexan-2-one Formula: C18H31NO5 MolecularWeight: 341.44244

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)NCC(=O)C(C(C(CO)O)O)O)C

Isomeric SMILES

CC12CC3CC(C1)(CC(C3)(C2)NCC(=O)[C@H]([C@H]([C@@H](CO)O)O)O)C

InChI

InChI=1S/C18H31NO5/c1-16-3-11-4-17(2,8-16)10-18(5-11,9-16)19-6-12(21)14(23)15(24)13(22)7-20/h11,13-15,19-20,22-24H,3-10H2,1-2H3/t11?,13-,14-,15+,16?,17?,18?/m1/s1