Imperatorin - 10mM in DMSO , CAS No.482-44-0

CAS: 482-44-0 Cat. No.: I424190 Formula: C₁₆H₁₄O₄ Peso molecolare: 270.28 Numero EC: 207-581-1

GRADE & PURITY 10mM in DMSO

Synonyms

NCGC00095209-05 | SCHEMBL50437 | 9-(3-Methyl-2-butenyloxy)-7-oxofuro[3,2-g]chromene | 9-(3-Methyl-but-2-enyloxy)-furo[3,2-g]chromen-7-one | 9-(3-Methylbut-2-enyloxy)furo[3,2-g]chromen-7-one | HMS2218G08 | SDCCGMLS-0066373.P001 | HMS3885G06 | NCGC00095209-

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Panoramica

Imperatorin is a furocoumarin present in citrus fruits, which is used in HIV-1 research. Studies indicate that the transcription factor Sp1 is essential in the inhibitory functions of Imperatorin. In addition, Imperatorin inhibits cyclin D1 expression and stops the cell cycle at G1. These studies also suggest that Imperatorin suppresses HIV-1 replication in primary T lymphocytes and transformed cell lines. Furthermore, it has been suggested that the inhibitory effects of Imperatorin on HIV-1 at the transcriptional level can be monitored effectively in HeLa cells. Imperatorin can also cause apoptosis in human promyelocytic leukaemia, HL-60 via the cytochrome c/caspase-9 pathway.

Specifications

Sinonimi

NCGC00095209-05 | SCHEMBL50437 | 9-(3-Methyl-2-butenyloxy)-7-oxofuro[3,2-g]chromene | 9-(3-Methyl-but-2-enyloxy)-furo[3,2-g]chromen-7-one | 9-(3-Methylbut-2-enyloxy)furo[3,2-g]chromen-7-one | HMS2218G08 | SDCCGMLS-0066373.P001 | HMS3885G06 | NCGC00095209-

Specifiche e purezza

10mM in DMSO

Meccanismi biochimici e fisiologici

Imperatorin is a furocoumarin present in citrus fruits, which is used in HIV-1 research. Studies indicate that the transcription factor Sp1 is essential in the inhibitory functions of Imperatorin. In addition, Imperatorin inhibits cyclin D1 expression and

Condizioni di conservazione di stoccaggio

Store at -80°C

Spedito in

Dry ice packs + Cold packs

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Tipo di azione

AGONIST

Nomi e identificatori

Pubchem Sid

504751913

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504751913

Sorrisi canonici

CC(=CCOC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)C

IUPAC Name

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

InChIKey

OLOOJGVNMBJLLR-UHFFFAOYSA-N

INCHI

1S/C16H14O4/c1-10(2)5-7-19-16-14-12(6-8-18-14)9-11-3-4-13(17)20-15(11)16/h3-6,8-9H,7H2,1-2H3

Isomeri SMILES

CC(=CCOC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)C

WGK Germania

3

Peso molecolare

270.28

Reaxy-Rn

249728

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=249728&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Phenylpropanoids and polyketides
• Classe: Coumarins and derivatives
• Subclass: Furanocoumarins
• Intermediate Tree Nodes: Linear furanocoumarins
• Direct Parent: Psoralens
• Alternative Parents: 1-benzopyrans Benzofurans Pyranones and derivatives Alkyl aryl ethers Benzenoids Heteroaromatic compounds Furans Lactones Oxacyclic compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Psoralen - Benzopyran - 1-benzopyran - Benzofuran - Alkyl aryl ether - Pyranone - Benzenoid - Pyran - Heteroaromatic compound - Furan - Lactone - Ether - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as psoralens. These are organic compounds containing a psoralen moiety, which consists of a furan fused to a chromenone to for 7H-furo[3,2-g]chromen-7-one.
• External Descriptors: Furanocoumarins

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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CYP1B1 Tchem Cytochrome P450 1B1 (1 Activities)

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VDR Tclin Vitamin D receptor (26531 Activities)

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CYP1B1 Tchem Cytochrome P450 1B1 (1148 Activities)

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PLK1 Tchem Serine/threonine-protein kinase PLK1 (28605 Activities)

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JAK1 Tclin Tyrosine-protein kinase JAK1 (8569 Activities)

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GAA Tclin Lysosomal alpha-glucosidase (35701 Activities)

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CYP1A1 Tchem Cytochrome P450 1A1 (1169 Activities)

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ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)

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DUSP3 Tchem Dual specificity protein phosphatase 3 (1161 Activities)

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STAT3 Tchem Signal transducer and activator of transcription 3 (3313 Activities)

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PTPN7 Tchem Protein-tyrosine phosphatase LC-PTP (886 Activities)

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GLP1R Tclin Glucagon-like peptide 1 receptor (111429 Activities)

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BACE1 Tchem Beta-secretase 1 (15641 Activities)

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CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)

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A549 (127892 Activities)

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MDA-MB-231 (73002 Activities)

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KDM4A Tchem Lysine-specific demethylase 4A (52245 Activities)

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APEX1 Tchem DNA-(apurinic or apyrimidinic site) lyase (38016 Activities)

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EHMT2 Tchem Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 (93046 Activities)

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EYA2 Tbio Eyes absent homolog 2 (5884 Activities)

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SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 (2672 Activities)

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RGS4 Tchem Regulator of G-protein signaling 4 (13867 Activities)

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IDH1 Tclin Isocitrate dehydrogenase [NADP] cytoplasmic (40980 Activities)

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Rela Transcription factor p65 (175 Activities)

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Sensibilità: Heat sensitive
• Punto di fusione (°C): 97.0 to 101.0 °C
• Peso molecolare: 270.280 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 270.089 Da
• Monoisotopic Mass: 270.089 Da
• Topological Polar Surface Area: 48.700 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 436.000
• 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