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Naringenin-d4

CAT: 0804-HY-N0100S-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N0100S-01Size:1 mg
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Description
Naringenin-d4 is the deuterated version of Naringenin. Naringenin shows strong anti-inflammatory and antioxidant activities. Naringenin has anti-dengue virus (DENV) activity[1].
CAS Number
1192260-78-8
UNSPSC
12352005
Target
Dengue Virus; Flavivirus; Isotope-Labeled Compounds
Type
Isotope-Labeled Compounds
Related Pathways
Anti-infection; Others
Field of Research
Others
Purity
99.88
Solubility
DMSO : 66.67mg/mL (ultrasonic)
Smiles
O=C1C[C@@H](C2=C([2H])C([2H])=C(O)C([2H])=C2[2H])OC3=CC(O)=CC(O)=C13
Molecular Formula
C15H8D4O5
Molecular Weight
276.28
References & Citations
[1]Bai Y, et, al. Pharmacokinetics and Metabolism of Naringin and Active Metabolite Naringenin in Rats, Dogs, Humans, and the Differences Between Species. Front Pharmacol. 2020 Mar 27;11:364.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported

Chemical Information

Naringenin-d4
CAS Number1192260-78-8
PubChem CID166642496
IUPAC Name(2S)-5,7-dihydroxy-2-(2,3,5,6-tetradeuterio-4-hydroxyphenyl)-2,3-dihydrochromen-4-one
Molecular FormulaC15H12O5
Molecular Weight276.28
XLogP2.4
Topological Polar Surface Area87
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity363
SMILES
[2H]C1=C(C(=C(C(=C1[C@@H]2CC(=O)C3=C(C=C(C=C3O2)O)O)[2H])[2H])O)[2H]
InChI
InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2/t13-/m0/s1/i1D,2D,3D,4D
InChIKey
FTVWIRXFELQLPI-MNZXJJDISA-N
Chemical Structure
2D Structure
2D structure of Naringenin-d4
CAS: 1192260-78-8
CID: 166642496
Formula: C15H12O5
MW: 276.28
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight276.28
XLogP32.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass276.09358046
Monoisotopic Mass276.09358046
Topological Polar Surface Area87 Ų
Heavy Atom Count20
Formal Charge0
Complexity363
Isotope Atom Count4
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes