Molecule ID: 4613280

IUPAC Name: 6,10,12,16-tetrahydroxy-2,4,8,11,14,18-hexaoxapentacyclo[10.6.0.01,15.03,7.03,10]octadecane-9,13-dione

Description: The molecule is an organic heteropentacyclic compound obtained by cyclodimerisation of ascorbic acid. It is an organic heteropentacyclic compound, a tetrol and a cyclic hemiketal.

SMILES: O=C1OC2C(O)COC23OC24OCC(O)C2OC(=O)C4(O)OC13O

SELFIES: [O][=C][O][C][C][Branch1][C][O][C][O][C][Ring1][=Branch1][O][C][O][C][C][Branch1][C][O][C][Ring1][=Branch1][O][C][=Branch1][C][=O][C][Ring1][#Branch2][Branch1][C][O][O][C][Ring2][Ring1][=Branch1][Ring1][#C][O]

InChI: InChI=1S/C12H12O12/c13-3-1-19-11-5(3)21-7(15)9(11,17)23-10(18)8(16)22-6-4(14)2-20-12(6,10)24-11/h3-6,13-14,17-18H,1-2H2

Molecular Properties:
- Polar Surface Area: 170.0 Ų
- LogP: -4.3