Molecule ID: 3126

IUPAC Name: 2-aminooctadecane-1,3-diol

Description: The molecule is an aminodiol that is octadecane bearing two hydroxy substituents at positions 1 and 3 as well as an amino substituent at position 2. It is a sphingoid and an aminodiol.

SMILES: CCCCCCCCCCCCCCCC(O)C(N)CO

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

InChI: InChI=1S/C18H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h17-18,20-21H,2-16,19H2,1H3

Molecular Properties:
- Polar Surface Area: 66.5 Ų
- LogP: 5.8