Molecule ID: 129320393

IUPAC Name: (2E,5S,6E,8E,10E)-1-aminododeca-2,6,8,10-tetraen-5-ol

Description: The molecule is an amino alcohol that is dodeca-2,6,8,10-tetraen-1-amine in which all four double bonds have trans configuration and in which the pro-S hydrogen at position 5 has been replaced by a hydroxy group. It is a primary allylic alcohol, a primary amino compound, an olefinic compound and an amino alcohol. It is a conjugate base of a (2E,5S,6E,8E,10E)-1-ammoniododeca-2,6,8,10-tetraen-5-ol.

SMILES: C/C=C/C=C/C=C/[C@@H](O)C/C=C/CN

SELFIES: [C][/C][=C][/C][=C][/C][=C][/C@@H1][Branch1][C][O][C][/C][=C][/C][N]

InChI: InChI=1S/C12H19NO/c1-2-3-4-5-6-9-12(14)10-7-8-11-13/h2-9,12,14H,10-11,13H2,1H3/b3-2+,5-4+,8-7+,9-6+/t12-/m1/s1

Molecular Properties:
- Polar Surface Area: 46.2 Ų
- LogP: 1.6