Psoralenoside | CAS No. 905954-17-8

Psoralenoside

Basic Information

View in Editor

CAS Number

905954-17-8

Molecular Formula

C17H18O9

Molecular Weight

366.32 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

Basic Physical Properties

Physical State

Powder

Solubility

Methanol; Acetontrile; Water; DMSO

SMILES

View in Editor

C1=COC2=CC(=C(C=C21)C=CC(=O)O)OC3C(C(C(C(O3)CO)O)O)O

InChI

InChI=1S/C17H18O9/c18-7-12-14(21)15(22)16(23)17(26-12)25-11-6-10-9(3-4-24-10)5-8(11)1-2-13(19)20/h1-6,12,14-18,21-23H,7H2,(H,19,20)/b2-1-/t12-,14-,15+,16-,17-/m1/s1

InChIKey

XRLPSAYLYDMYGX-UETKAVOHSA-N

LogP

-0.2907000000000004

Topological Polar Surface Area

149.82 Å²

Hydrogen Bond Donor/Acceptor

5 / 9

Complexity

524

Safety Information

View Safety Information

Storage Conditions

-20℃

Synonyms & References

English

Psoralenoside
(2Z)-3-[6-(β-D-Glucopyranosyloxy)-1-benzofuran-5-yl]acrylic acid
(2Z)-3-[6-(β-D-Glucopyranosyloxy)-5-benzofuranyl]-2-propenoic acid (ACI)
Psoralic acid glucoside
CS-0131105
AKOS040760107
1ST169948
Psoralenoside(Z)-3-[6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-benzofuran-5-yl]prop-2-enoic acid
MS-25854
(Z)-3-(6-(((2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)benzofuran-5-yl)acrylic acid
HY-N7503
CHEMBL4213781
AC-34047
E80540
(Z)-3-[6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-benzofuran-5-yl]prop-2-enoic acid
DA-66992
BDBM50456385
905954-17-8

MDL Number

MFCD21333545

FAQ

What are the physical and chemical properties of Psoralenoside (CAS: 905954-17-8)?

Psoralenoside (CAS: 905954-17-8) is a crystalline compound with a molecular weight of approximately 326.26 g/mol. It has a melting point of 235-238°C and is slightly soluble in water but soluble in ethanol and methanol. It exhibits limited reactivity under normal conditions but can undergo photochemical reactions under UV light exposure.

How is Psoralenoside (CAS: 905954-17-8) typically synthesized?

Psoralenoside (CAS: 905954-17-8) is typically synthesized by coupling psoralen with glucose derivatives. The synthesis involves the use of catalytic amounts of acids or bases, and the reaction proceeds with good selectivity and yield. This process is often carried out under mild conditions to ensure high purity of the final product.

What industries use Psoralenoside (CAS: 905954-17-8)?

Psoralenoside (CAS: 905954-17-8) is used in the pharmaceutical industry for the development of topical treatments for psoriasis and other skin conditions. It is also utilized in the production of UV-absorbing compounds for photoprotective applications. Additionally, it has potential applications in the food industry as a natural UV stabilizer and antioxidant.

What precautions should be taken when handling Psoralenoside (CAS: 905954-17-8)?

When handling Psoralenoside (CAS: 905954-17-8), it is important to wear appropriate personal protective equipment (PPE), including gloves and safety goggles, to prevent skin and eye exposure. This compound can cause photosensitivity, so it should be stored away from light and used with proper ventilation. In case of spillage, immediately clean up with appropriate absorbent material and consult the Safety Data Sheet (SDS) for further instructions.