(3S)-5-Hydroxy-2,2,8-trimethyl-6-oxo-3,4-dihydro-2H,6H-pyrano[3,2-g]chromen-3-yl beta-D-glucopyranoside

Basic Information

View in Editor

CAS Number

80681-44-3

Molecular Formula

C21H26O10

Molecular Weight

438.43 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

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

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Physical State

Powder

Boiling Point

677.517℃ at 760 mmHg

Solubility

Methanol,Ethanol

SMILES

View in Editor

CC1=CC(=O)C2=C(C3=C(C=C2O1)OC(C(C3)OC4C(C(C(C(O4)CO)O)O)O)(C)C)O

InChI

InChI=1S/C21H26O10/c1-8-4-10(23)15-12(28-8)6-11-9(16(15)24)5-14(21(2,3)31-11)30-20-19(27)18(26)17(25)13(7-22)29-20/h4,6,13-14,17-20,22,24-27H,5,7H2,1-3H3/t13-,14+,17-,18+,19-,20+/m1/s1

InChIKey

QVUPQEXKTXSMKX-JJDILSOYSA-N

LogP

-0.29438000000000025

Topological Polar Surface Area

159.05 Å²

Hydrogen Bond Donor/Acceptor

5 / 10

Complexity

723

Safety Information

View Safety Information

Storage Conditions

2-8℃

Synonyms & References

English

80681-44-3
AC-34271
Q-100836
AS-57699
C17484
CS-0008933
MFCD11042255
(3S)-5-hydroxy-2,2,8-trimethyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydropyrano[3,2-g]chromen-6-one
AKOS037514832
s9173
Hamaudol 3-glucoside
sec-o-Glucosylhamaudol
CHEBI:81124
CCG-269108
HY-N0398
Q27155080
(S)-5-Hydroxy-2,2,8-trimethyl-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H,6H-pyrano[3,2-g]chromen-6-one
Sec-O-Glucosylhamaudol
(3S)-5-hydroxy-2,2,8-trimethyl-3-[(1R,2R,3S,4R,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]oxy-3,4-dihydropyrano[3,2-g]chromen-6-one
2H,6H-Benzo[1,2-b:5,4-b']dipyran-6-one,3-(b-D-glucopyranosyloxy)-3,4-dihydro-5-hydroxy-2,2,8-trimethyl-,(3S)-
A14495
(3S)-5-Hydroxy-2,2,8-trimethyl-3-[(2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3
Y0184
681S443
2H,6H-Benzo[1,2-b:5,4-b']dipyran-6-one, 3-(β-D-glucopyranosyloxy)-3,4-dihydro-5-hydroxy-2,2,8-trimet...

MDL Number

MFCD11042255

FAQ

What is (3S)-5-Hydroxy-2,2,8-trimethyl-6-oxo-3,4-dihydro-2H,6H-pyrano[3,2-g]chromen-3-yl beta-D-glucopyranoside (CAS: 80681-44-3)?

(3S)-5-Hydroxy-2,2,8-trimethyl-6-oxo-3,4-dihydro-2H,6H-pyrano[3,2-g]chromen-3-yl beta-D-glucopyranoside is a glycoside compound with a complex structure. It consists of a chromenone derivative connected to a glucose molecule. This compound is known for its potential bioactivity and is used in pharmaceutical research and development.

What are the main uses of (3S)-5-Hydroxy-2,2,8-trimethyl-6-oxo-3,4-dihydro-2H,6H-pyrano[3,2-g]chromen-3-yl beta-D-glucopyranoside (CAS: 80681-44-3)?

This compound is primarily used in pharmaceutical research for its demonstrated bioactivity. It may also be utilized in natural product chemistry and as a potential lead compound for drug development due to its unique chemical structure and biological properties.

Is (3S)-5-Hydroxy-2,2,8-trimethyl-6-oxo-3,4-dihydro-2H,6H-pyrano[3,2-g]chromen-3-yl beta-D-glucopyranoside (CAS: 80681-44-3) safe?

The safety of (3S)-5-Hydroxy-2,2,8-trimethyl-6-oxo-3,4-dihydro-2H,6H-pyrano[3,2-g]chromen-3-yl beta-D-glucopyranoside depends on the context of use. It is generally considered safe for research and industrial applications when handled with appropriate precautions. However, it is important to follow all recommended safety guidelines, including the use of appropriate personal protective equipment (PPE) and working in a well-ventilated area. Always consult the Material Safety Data Sheet (MSDS) for specific safety information.

How should (3S)-5-Hydroxy-2,2,8-trimethyl-6-oxo-3,4-dihydro-2H,6H-pyrano[3,2-g]chromen-3-yl beta-D-glucopyranoside (CAS: 80681-44-3) be stored?

This compound should be stored in a cool, dry place away from direct sunlight. It should be kept in a tightly sealed container to prevent moisture absorption. Optimal storage conditions are at a temperature below 25°C and with a relative humidity below 60%. Ensure that the storage area is well-ventilated and avoid contact with incompatible materials. Proper labeling of the container with the compound's name and CAS number is also recommended for safety purposes.