Molecule ID: 154373

IUPAC Name: (1R,2R)-2-(2-hydroxyethyl)-3,4-bis(hydroxymethyl)cyclopent-3-en-1-ol

Description: The molecule is an alicyclic compound that is cyclopent-3-en-1-ol carrying additional hydroxymethyl substituents at positions 3 and 4 as well as a 2-hydroxyethyl substituent at position 2 (the 1R,2R-diastereomer). It has a role as a sedative and a plant metabolite. It is a tetrol, a primary allylic alcohol and an alicyclic compound.

SMILES: OCC[C@@H]1C(CO)=C(CO)C[C@H]1O

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

InChI: InChI=1S/C9H16O4/c10-2-1-7-8(5-12)6(4-11)3-9(7)13/h7,9-13H,1-5H2/t7-,9-/m1/s1

Molecular Properties:
- Polar Surface Area: 80.9 Ų
- LogP: -2.4