Molecule ID: 448760

IUPAC Name: [(1S,2R,4S,5R)-5-azaniumyl-2,3,4-trihydroxycyclohexyl]azanium

Description: The molecule is an organic cation obtained by protonation of the two free amino groups of 2-deoxystreptamine; major species at pH 7.3. It is an ammonium ion derivative and an organic cation. It is a conjugate acid of a 2-deoxystreptamine(1+).

SMILES: [NH3+][C@@H]1C[C@H]([NH3+])[C@@H](O)C(O)[C@H]1O

SELFIES: [NH3+1][C@@H1][C][C@H1][Branch1][C][NH3+1][C@@H1][Branch1][C][O][C][Branch1][C][O][C@H1][Ring1][=Branch2][O]

InChI: InChI=1S/C6H14N2O3/c7-2-1-3(8)5(10)6(11)4(2)9/h2-6,9-11H,1,7-8H2/p+2/t2-,3+,4+,5-,6?

Molecular Properties:
- Polar Surface Area: 116.0 Ų
- LogP: -3.2