2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)-

• CAS: 18829-70-4
• Catalog Number: ACM18829704
• Category: Other Products
• Molecular Weight: 290.27
• Molecular Formula: C15H14O6
• Description: (-)-Catechin is a natural polyphenol found in green tea, cocoa, apples, and other fruits and vegetables. It is an antioxidant that has been studied for its potential health benefits, such as reducing inflammation and protecting against cardiovascular disease, cancer, and other chronic diseases. (-)-Catechin has been extensively studied in the laboratory, and its therapeutic and protective effects have been demonstrated in both animal and human studies.
• Synonyms: (-)-Catechin
• IUPAC Name: (2S,3R)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
• Canonical SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O
• InChI: InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15+/m1/s1
• InChI Key: PFTAWBLQPZVEMU-HIFRSBDPSA-N
• Boiling Point: 630.4ºC at 760 mmHg
• Melting Point: 175-176ºC
• Flash Point: 335ºC
• Density: 1.593 g/mL
• Appearance: solid
• Application: (-)-Catechin has been studied for its potential health benefits, such as reducing inflammation and protecting against cardiovascular disease, cancer, and other chronic diseases. It has been used in laboratory studies to investigate its anti-inflammatory, anti-cancer, and anti-oxidant effects. It has also been studied for its potential to protect against neurological diseases, such as Alzheimer's and Parkinson's.
• Storage: Store at 2-8 ℃
• EC Number: 242-611-7
• Exact Mass: 290.079
• H-Bond Acceptor: 6
• H-Bond Donor: 5
• Isomeric SMILES: C1[C@H]([C@@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O
• MDL Number: MFCD00135997
• PSA: 110.38
• Vapor Pressure: 1.09E-20mmHg at 25°C
• WGK Germany: 3
• XLogP3: 1.5461

Case Study

The Role of Catechins in Human Health and Disease

Mamoru Isemura. Molecules 2019, 24(3), 528.

Catechins have many beneficial properties for human health, such as anti-cancer, anti-obesity, anti-diabetic, anti-cardiovascular, anti-infectious, hepatoprotective and neuroprotective effects.
The beneficial biochemical properties of catechins include antioxidant activity, pro-oxygen activity, anti-inflammatory activity, protein kinase C-related and neurotransmission-related properties, and more. The mechanism of action of catechins mainly involves the mechanism of reactive oxygen species (ROS).

Custom Q&A

What is the molecular formula of 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)-?

The molecular formula of 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)- is C15H16O7.

What is the molecular weight of 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)-?

The molecular weight of 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)- is 308.28 g/mol.

What is the IUPAC name of 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)-?

The IUPAC name of 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)- is (2S,3R)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol;hydrate.

What is the InChIKey of 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)-?

The InChIKey of 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)- is OFUMQWOJBVNKLR-PBCQUBLHSA-N.

How many hydrogen bond donor counts are there in 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)-?

There are 6 hydrogen bond donor counts in 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)-.

How many hydrogen bond acceptor counts are there in 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)-?

There are 7 hydrogen bond acceptor counts in 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)-.

What is the exact mass of 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)-?

The exact mass of 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)- is 308.08960285 g/mol.

How many heavy atom counts are there in 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)-?

There are 22 heavy atom counts in 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)-.

What is the topological polar surface area of 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)-?

The topological polar surface area of 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)- is 111Ų.

What is the complexity of 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)-?

The complexity of 2H-1-Benzopyran-3,5,7-triol,2-(3,4-dihydroxyphenyl)-3,4-dihydro-,(2S,3R)- is 364.