Molecule ID: 6920143

IUPAC Name: [(2R)-2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]-methylazanium

Description: The molecule is an organic cation that is the conjugate acid of (R)-adrenaline, obtained by protonation of the amino group; major species at pH 7.3. It has a role as a human metabolite. It is an organic cation and an ammonium ion derivative. It is a conjugate acid of a (R)-adrenaline.

SMILES: C[NH2+]C[C@H](O)c1ccc(O)c(O)c1

SELFIES: [C][NH2+1][C][C@H1][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][Branch2]

InChI: InChI=1S/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/p+1/t9-/m0/s1

Molecular Properties:
- Polar Surface Area: 77.3 Ų
- LogP: -1.4