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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@]12CC3C[C@@](C1)(CC(C3)(C2)NC(CO)C(=O)C([C@@H](CO)O)O)C

InChI

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