Ono-DI-004

4-[2-[(1R,2R,3R)-3-hydroxy-2-[(E,3S,5S)-3-hydroxy-5-methylnon-1-enyl]-5-oxocyclopentyl]acetyl]cyclohexane-1-carboxylic acid

Also Known As: ONO-DI-004|ONO-DI 004|GTPL1914|J1.712.120K|4-[2-[(1R,2R,3R)-3-hydroxy-2-[(E,3S,5S)-3-hydroxy-5-methylnon-1-enyl]-5-oxocyclopentyl]acetyl]cyclohexane-1-carboxylic acid|(1r,4r)-4-{2-[(1R,2R,3R)-3-hydroxy-2-[(1E,3S,5S)-3-hydroxy-5-methylnon-1-en-1-yl]-5-oxocyclopentyl]acetyl}cyclohexane-1-carboxylic acid|4-({(1R,2R,3R)-3-Hydroxy-2-[(1E,3S,5S)-3-hydroxy-5-methylnon-1-en-1-yl]-5-oxocyclopentyl}acetyl)cyclohexane-1-carboxylic acid|4-(2-((1R,2R,3R)-3-hydroxy-2-((E,3S,5S)-3-hydroxy-5-methylnon-1-enyl)-5-oxocyclopentyl)acetyl)cyclohexane-1-carboxylic acid|4alpha-[[(1R,2R,3R)-3-Hydroxy-2-[(1E,3S,5S)-3-hydroxy-5-methyl-1-nonenyl]-5-oxocyclopentyl]acetyl]cyclohexane-1beta-carboxylic acid

Molecular Formula	C24H38O6
Molecular Weight	422.26685 g/mol
LogP	3.5362
Topological Polar Surface Area	111.9 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	5
Rotatable Bonds	11
Exact Mass	422.26685
Monoisotopic Mass	422.26685
Heavy Atoms	30
Complexity	619.18567

Chemical Identifiers

CAS Number	87-71-8
SMILES	CCCC[C@H](C)C[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1CC(=O)C2CCC(CC2)C(=O)O)O)O