Molecule ID: 86289971

IUPAC Name: (2S,3S,4R)-2-aminotetradecane-1,3,4-triol

Description: The molecule is a sphingoid that is the C14-analogue of phytosphingosine. It is a sphingoid, an amino alcohol and a triol. It is a conjugate base of a tetradecaphytosphingosine(1+).

SMILES: CCCCCCCCCC[C@@H](O)[C@@H](O)[C@@H](N)CO

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

InChI: InChI=1S/C14H31NO3/c1-2-3-4-5-6-7-8-9-10-13(17)14(18)12(15)11-16/h12-14,16-18H,2-11,15H2,1H3/t12-,13+,14-/m0/s1

Molecular Properties:
- Polar Surface Area: 86.7 Ų
- LogP: 2.5