(5S,6R,7R,8S)-5,6,7,8-Tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydro-4H-chromen-4-one

Basic Information

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CAS Number

69809-22-9

Molecular Formula

C17H18O6

Molecular Weight

318.33 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Powder

Density

1.48±0.1 g/cm3 (20 ºC 760 Torr),

SMILES

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c1ccc(cc1)CCc2cc(=O)c3c(o2)[C@H]([C@@H]([C@@H]([C@H]3O)O)O)O

InChI

InChI=1S/C17H18O6/c18-11-8-10(7-6-9-4-2-1-3-5-9)23-17-12(11)13(19)14(20)15(21)16(17)22/h1-5,8,13-16,19-22H,6-7H2/t13-,14+,15+,16-/m0/s1

InChIKey

CWMIROLCTHMEEO-JJXSEGSLSA-N

LogP

0.22719999999999974

Topological Polar Surface Area

111.13000000000001 Å²

Hydrogen Bond Donor/Acceptor

4 / 6

Complexity

531

Safety Information

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Storage Conditions

-20℃

Synonyms & References

English

Agarotetrol
(5S,6R,7R,8S)-5,6,7,8-Tetrahydro-5,6,7,8-tetrahydroxy-2-(2-phenylethyl)-4H-1-benzopyran-4-one
Agarotetrol (AHl)
2-(2-phenylethyl)-5,6,7,8-tetrahydroxy-5,6,7,8-tetrahydrochromone
5,6,7,8-Tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydrochromen-4-one
(5S,6R,7R,8S)-5,6,7,8-tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydrochromen-4-one
s3263
(5S)-5,6,7,8-Tetrahydro-5alpha,6beta,7beta,8alpha-tetrahydroxy-2-(2-phenylethyl)-4H-1-benzopyran-4-one
(5s,6r,7r,8s)-5,6,7,8-tetrahydroxy 2-(2-phenylethyl)-5,6,7,8-tetrahydro-4h-chromen-4-one

MDL Number

MFCD30533225

FAQ

What regulatory guidelines apply to (5S,6R,7R,8S)-5,6,7,8-Tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydro-4H-chromen-4-one (CAS: 69809-22-9)?

The compound (5S,6R,7R,8S)-5,6,7,8-Tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydro-4H-chromen-4-one (CAS: 69809-22-9) is subject to the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) guidelines, REACH (Registration, Evaluation, Authorisation and Restriction of Chemicals) regulations in the EU, and FDA/EPA requirements for chemical safety and environmental protection. Specific regulations may vary based on the intended use and location.

Are there alternatives to (5S,6R,7R,8S)-5,6,7,8-Tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydro-4H-chromen-4-one in synthesis?

Synthesis alternatives for (5S,6R,7R,8S)-5,6,7,8-Tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydro-4H-chromen-4-one (CAS: 69809-22-9) may include using isomers or analogs like (5S,6R,7R,8S)-5,6,7,8-tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydro-4H-chromen-4-one derivatives or similar compounds, which offer similar functionalities but with slight structural differences. Common substitute reagents might include phenols, alcohols, or ketones.

What is the market or research trend for (5S,6R,7R,8S)-5,6,7,8-Tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydro-4H-chromen-4-one (CAS: 69809-22-9)?

The market trend for (5S,6R,7R,8S)-5,6,7,8-Tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydro-4H-chromen-4-one (CAS: 69809-22-9) shows a focus on its potential applications in pharmaceuticals and cosmetics due to its bioactive properties. Research trends are increasingly exploring its use in drug discovery and development, particularly in areas like anti-inflammatory and anti-cancer treatments. Market demand is expected to grow with advancements in these fields.

How should waste containing (5S,6R,7R,8S)-5,6,7,8-Tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydro-4H-chromen-4-one (CAS: 69809-22-9) be handled?

Waste containing (5S,6R,7R,8S)-5,6,7,8-Tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydro-4H-chromen-4-one (CAS: 69809-22-9) should be collected and disposed of in accordance with local environmental regulations. Proper waste disposal methods include incineration for hazardous components and professional waste management for non-hazardous waste. Environmental precautions include ensuring containment to prevent spillage and contamination. It is advisable to consult with environmental safety experts for specific disposal guidelines.