Molecule ID: 11123535

IUPAC Name: (E,5R)-5-[(1R,5R,6Z,9Z,13R,15R)-5-acetyloxy-10-chloro-6-methyl-3-oxo-2,14-dioxabicyclo[11.2.1]hexadeca-6,9-dien-15-yl]-5-hydroxy-3-methylpent-3-enoic acid

Description: The molecule is a 14-membered macrolide isolated from the Serratia liquefaciens and exhibits anti-hyperlipidemic activity. It has a role as a metabolite and an antilipemic drug. It is a macrolide, a hydroxy monocarboxylic acid, a cyclic ether, an acetate ester, a secondary alcohol, an organochlorine compound, an organic heterobicyclic compound and a bridged compound.

SMILES: CC(=O)O[C@@H]1CC(=O)O[C@@H]2C[C@@H](CC/C(Cl)=C/C/C=C\1C)O[C@@H]2[C@H](O)/C=C(\C)CC(=O)O

SELFIES: [C][C][=Branch1][C][=O][O][C@@H1][C][C][=Branch1][C][=O][O][C@@H1][C][C@@H1][Branch1][=C][C][C][/C][Branch1][C][Cl][=C][/C][/C][=C][-\Ring1][S][C][O][C@@H1][Ring1][=C][C@H1][Branch1][C][O][/C][=C][Branch1][C][\C][C][C][=Branch1][C][=O][O]

InChI: InChI=1S/C23H31ClO8/c1-13(10-21(27)28)9-18(26)23-20-11-17(31-23)8-7-16(24)6-4-5-14(2)19(30-15(3)25)12-22(29)32-20/h5-6,9,17-20,23,26H,4,7-8,10-12H2,1-3H3,(H,27,28)/b13-9+,14-5-,16-6-/t17-,18-,19-,20-,23-/m1/s1

Molecular Properties:
- Polar Surface Area: 119.0 Ų
- LogP: 2.5