UC455
3-Cyano-7-ethoxycoumarin
≥97% (HPLC)
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About This Item
Empirical Formula (Hill Notation):
C12H9NO3
CAS Number:
Molecular Weight:
215.20
MDL number:
UNSPSC Code:
12161501
PubChem Substance ID:
Assay
≥97% (HPLC)
form
solid
color
yellow to orange
storage temp.
2-8°C
SMILES string
CCOc1ccc2C=C(C#N)C(=O)Oc2c1
InChI
1S/C12H9NO3/c1-2-15-10-4-3-8-5-9(7-13)12(14)16-11(8)6-10/h3-6H,2H2,1H3
InChI key
YAFGHMIAFYQSCF-UHFFFAOYSA-N
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General description
3-Cyano-7-ethoxycoumarin is a fluorescent substrate for Cytochrome P450 1A1 (CYP1A1), Cytochrome P450 1A2 (CYP1A2), Cytochrome P450 2C9 (CYP2C9) and Cytochrome P450 2C19 (CYP2C19).
Application
3-Cyano-7-ethoxycoumarin has been used as a substrate in cytochrome P (CYP) inhibition for fluorescence measurement.
Biochem/physiol Actions
Fluorescent probe useful in microsomal dealkylase studies.
Fluorescent probe useful in microsomal dealkylase studies. Typical drug-drug interactions resulting from enzyme inhibition.
Packaging
Bottomless glass bottle. Contents are inside inserted fused cone.
Preparation Note
3-Cyano-7-ethoxycoumarin is soluble in DMSO.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Anima Ghosal et al.
Biopharmaceutics & drug disposition, 24(9), 375-384 (2003-12-23)
Cytochrome P450 (CYP) substrates that yield fluorescent metabolites were used for rapid screening of drug metabolism activities of 13 recombinant human cytochromes P450, human liver microsomes and human hepatocytes. Reproducible results were obtained using a fluorescent plate reader (CytoFluor) more
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Biopharmaceutics & Drug Disposition, 24(9), 375-384 (2003)
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