Phellopterin - ≥99% , CAS No.2543-94-4

CAS: 2543-94-4 Cat. No.: P649249 Formule: C₁₇H₁₆O₅ Poids moléculaire: 300.31 Numéro CE: 110-046-4

QUALITÉ & PURETÉ ≥99%

Synonyms

Q3742334 | NSC 152469 | NSC152469 | NSC-152469 | Methanesulfinic acid, 1,1,1-trifluoro-, sodium salt (1:1) | 4-Methoxy-9-prenyloxypsoralen | C17047 | HMS2203M11 | Phelloptorin | NCGC00247535-01 | 4-Methoxy-9-((3-methylbut-2-en-1-yl)oxy)-7H-furo[3,2-g]chro

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Vue d’ensemble

Phellopterin is a natural product isolated from Angelica dahurica. Phellopterin reduces TNF-alpha-induced VCAM-1 expression through regulation of the Akt and PKC pathway, which contributes to inhibit the adhesion of monocytes to endothelium.

Form:Solid

Spécifications

Synonymes

Q3742334 | NSC 152469 | NSC152469 | NSC-152469 | Methanesulfinic acid, 1,1,1-trifluoro-, sodium salt (1:1) | 4-Methoxy-9-prenyloxypsoralen | C17047 | HMS2203M11 | Phelloptorin | NCGC00247535-01 | 4-Methoxy-9-((3-methylbut-2-en-1-yl)oxy)-7H-furo[3,2-g]chro

Spécifications et pureté

≥99%

Mécanismes biochimiques et physiologiques

Phellopterin is a natural product isolated from Angelica dahurica . Phellopterin reduces TNF-alpha-induced VCAM-1 expression through regulation of the Akt and PKC pathway, which contributes to inhibit the adhesion of monocytes to endothelium.

Conditions de stockage de stockage

Protected from light,Store at -20°C

Expédié en

Ice chest + Ice pads

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥99%

Noms et identifiants

Pubchem Sid

528773295

Sourires canoniques

COc1c2ccoc2c(OCC=C(C)C)c2oc(=O)ccc12

IUPAC Name

4-methoxy-9-(3-methylbut-2-enoxy)furo[3,2-g]chromen-7-one

InChIKey

BMLZFLQMBMYVHG-UHFFFAOYSA-N

INCHI

1S/C17H16O5/c1-10(2)6-8-21-17-15-12(7-9-20-15)14(19-3)11-4-5-13(18)22-16(11)17/h4-7,9H,8H2,1-3H3

Isomères SMILES

CC(=CCOC1=C2C(=C(C3=C1OC(=O)C=C3)OC)C=CO2)C

CAS alternatif

2543-94-4

Numéro NSC

152469

Termes d'entrée MeSH

phellopterin

Poids moléculaire

300.31

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Phenylpropanoids and polyketides
    • Classe Coumarins and derivatives
      • Subclass Furanocoumarins
        • Level5 Linear furanocoumarins
          • Level6 Psoralens
            • Level7 5-methoxypsoralens

• Kingdom: Organic compounds
• Superclass: Phenylpropanoids and polyketides
• Classe: Coumarins and derivatives
• Subclass: Furanocoumarins
• Intermediate Tree Nodes: Linear furanocoumarins - Psoralens
• Direct Parent: 5-methoxypsoralens
• Alternative Parents: 1-benzopyrans Benzofurans Anisoles Pyranones and derivatives Alkyl aryl ethers Heteroaromatic compounds Furans Lactones Oxacyclic compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 5-methoxypsoralen - Benzopyran - 1-benzopyran - Benzofuran - Anisole - Alkyl aryl ether - Pyranone - Pyran - Benzenoid - Furan - Heteroaromatic compound - Lactone - Oxacycle - Ether - Organoheterocyclic compound - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as 5-methoxypsoralens. These are psoralens containing a methoxy group attached at the C5 position of the psoralen group.
• External Descriptors: psoralens

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

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Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: DMSO : 100 mg/mL (332.99 mM; Need ultrasonic)
• Sensibilité: Light sensitive
• Poids moléculaire: 300.300 g/mol
• XLogP3: 3.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 300.1 Da
• Monoisotopic Mass: 300.1 Da
• Topological Polar Surface Area: 57.900 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 479.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1