1-((5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-4-hydroxyproline structure

1-((5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-4-hydroxyproline

1-(5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl)-4-hydroxypyrrolidine-2-carboxylic acid

Also Known As: Hydroxyproline ochratoxin A|1-((5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-4-hydroxyproline|Proline, 1-((5-chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-4-hydroxy-|1-(5-Chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carbonyl)-4-hydroxyproline|1-(5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carbonyl)-4-hydroxypyrrolidine-2-carboxylic acid|1-(5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl)-4-hydroxypyrrolidine-2-carboxylic acid|1-(5-chloro-8-hydroxy-3-methyl-1-oxo-isochroman-7-carbonyl)-4-hydroxy-pyrrolidine-2-carboxylic acid|1-[[[3,4-Dihydro-1-oxo-3-methyl-5-chloro-8-hydroxy-1H-2-benzopyran]-7-yl]carbonyl]-4-hydroxy-2-pyrrolidinecarboxylic acid

CAS: 56222-75-4
Molecular Formula C16H16ClNO7
Molecular Weight 369.06152 g/mol
LogP 0.807
Topological Polar Surface Area 124.37 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 6
Rotatable Bonds 2
Exact Mass 369.06152
Monoisotopic Mass 369.06152
Heavy Atoms 25
Complexity 778.237

Chemical Identifiers

CAS Number 56222-75-4
SMILES CC1CC2=C(C=C(C(=C2C(=O)O1)O)C(=O)N3CC(CC3C(=O)O)O)Cl

Product Overview

1-((5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-4-hydroxyproline (CAS 56222-75-4), with molecular formula C16H16ClNO7 and molecular weight 369.06152 g/mol. IUPAC: 1-(5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl)-4-hydroxypyrrolidine-2-carboxylic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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1-((5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-4-hydroxyproline is a custom synthesis product. We offer services from milligram to kilogram scale.

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