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3-CPs

CAT: 0013-GTR19206641-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19206641-01Size:1 mg
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Description
3-Carbethoxypsoralen (3-CPs) is a psoralen-family compound that modulates bleomycin-induced lung fibrosis in mice by interfering with serotypic podoplanin polysaccharide and antibody-mediated bacterial killing. It serves as a useful research tool for investigating pulmonary fibrosis, airway inflammation, and asthma in both in vivo and in vitro experimental models.
CAS Number
20073-24-9
Product Name Alternative
3-Carbethoxypsoralen, 3-Ethoxycarbonylpsoralen, 3 CPs, 3CPs, 3-CPs, Antibiotic
Field of Research
Infectious Disease & Virology, Signal Transduction
Purity
97.58% (May vary between batches)
Smiles
O=C1OC=2C=C3OC=CC3=CC2C=C1C (=O) OCC
Molecular Formula
C14H10O5
Molecular Weight
258.23
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate

3-(ethoxycarbonyl)psoralen is an ethyl ester and a member of psoralens.

CAS Number20073-24-9
PubChem CID62739
IUPAC Nameethyl 7-oxofuro[3,2-g]chromene-6-carboxylate
Molecular FormulaC14H10O5
Molecular Weight258.23
XLogP2.7
Topological Polar Surface Area65.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count19
Formal Charge0
Complexity428
SMILES
CCOC(=O)C1=CC2=C(C=C3C(=C2)C=CO3)OC1=O
InChI
InChI=1S/C14H10O5/c1-2-17-13(15)10-6-9-5-8-3-4-18-11(8)7-12(9)19-14(10)16/h3-7H,2H2,1H3
InChIKey
CFQAMEDTKHNQTP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethyl 7-oxo-7H-furo(3,2-g)(1)benzopyran-6-carboxylate
CAS: 20073-24-9
CID: 62739
Formula: C14H10O5
MW: 258.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight258.23
XLogP32.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass258.05282342
Monoisotopic Mass258.05282342
Topological Polar Surface Area65.7 Ų
Heavy Atom Count19
Formal Charge0
Complexity428
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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