Demethoxydeacetoxypseudolaric acid B

Basic Information

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CAS Number

82508-36-9

Molecular Formula

C20H24O7

Molecular Weight

376.4 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Powder

SMILES

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C/C(=C\C=C\[C@@]1(C)OC(=O)[C@]23[C@]([C@H]1CC2)(O)CCC(=CC3)C(=O)O)/C(=O)O

InChI

InChI=1S/C20H24O7/c1-12(15(21)22)4-3-8-18(2)14-7-10-19(17(25)27-18)9-5-13(16(23)24)6-11-20(14,19)26/h3-5,8,14,26H,6-7,9-11H2,1-2H3,(H,21,22)(H,23,24)/b8-3+,12-4+/t14-,18+,19+,20-/m0/s1

InChIKey

QPFFEVMIQIJTGZ-XYWPTNBISA-N

LogP

2.2114

Topological Polar Surface Area

121.13000000000001 Å²

Hydrogen Bond Donor/Acceptor

3 / 7

Complexity

792

Synonyms & References

English

Demethoxydeacetoxypseudolaric-acid-B
(3R,4R,4aS,9aR)-3-[(1E,3E)-4-Carboxypenta-1,3-dien-1-yl]-4a-hydroxy-3-methyl-1-oxo-3,4,4a,5,6,9-hexahydro-4,9a-ethanocyclohepta[c]pyran-7(1H)-carboxylic acid
1H-4,9a-Ethanocyclohepta[c]pyran-7-carboxylic acid, 3-[(1E,3E)-4-carboxy-1,3-pentadien-1-yl]-3,4,4a,5,6,9-hexahydro-4a-hydroxy-3-methyl-1-oxo-, (3R,4R,4aS,9aR)-
Psdudolaric acid B derivative
Deacetylpseudolaric acid C2
(1R,7S,8R,9R)-9-[(1E,3E)-4-Carboxy-1,3-pentadien-1-yl]-7-hydroxy-9-methyl-11-oxo-10-oxatricyclo[6.3.2.0<sup>1,7</sup>]tridec-3-ene-4-carboxylic acid
Demethoxydeacetoxypseudolaric acid B
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MDL Number

MFCD20260469

FAQ

What regulatory guidelines apply to Demethoxydeacetoxypseudolaric acid B (CAS: 82508-36-9)?

Demethoxydeacetoxypseudolaric acid B (CAS: 82508-36-9) is subject to various regulatory guidelines such as the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), European Union REACH regulations, and FDA/EPA requirements for chemical substances. Manufacturers and importers must ensure compliance with these regulations, including proper labeling, safety data sheets, and environmental considerations.

Are there alternatives to Demethoxydeacetoxypseudolaric acid B in synthesis (CAS: 82508-36-9)?

In the synthesis of Demethoxydeacetoxypseudolaric acid B (CAS: 82508-36-9), there are alternative reagents and processes that can be used. For instance, researchers might consider using isomers or analogs such as dehydrodemethoxydeacetoxypseudolaric acid or other related compounds. These alternatives can offer similar functionalities while potentially simplifying the synthesis process or improving yield.

What is the market or research trend for Demethoxydeacetoxypseudolaric acid B (CAS: 82508-36-9)?

The market and research trends for Demethoxydeacetoxypseudolaric acid B (CAS: 82508-36-9) are centered around its potential applications in pharmaceuticals and natural product research. Recent studies have shown increasing interest in its bioactive properties, particularly in anticancer and anti-inflammatory activities. The demand is expected to grow as more clinical and preclinical studies validate its therapeutic potential.

How should waste containing Demethoxydeacetoxypseudolaric acid B (CAS: 82508-36-9) be handled?

Waste containing Demethoxydeacetoxypseudolaric acid B (CAS: 82508-36-9) should be handled according to local and regulatory guidelines. Typically, this involves collecting waste liquids in appropriate containers, ensuring proper labeling, and disposing of them through professional waste disposal services. Environmental protection precautions, such as preventing spillage and ensuring safe transportation, are crucial to avoid environmental contamination and ensure worker safety.