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(R) -Isosakuranetin

CAT: 0013-GTR19267623-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19267623-01Size:10 mg
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Description
(R) -Isosakuranetin is an isomer of Isosakuranetin, a flavanone flavonoid found in the fruit of Citrus bergamia. Additionally, Isosakuranetin serves as a TRPM3 blocker.
CAS Number
221362-74-9
Field of Research
Pharmacology & Drug Discovery
Smiles
O=C1C=2C (O[C@H] (C1) C3=CC=C (OC) C=C3) =CC (O) =CC2O
Molecular Formula
C16H14O5
Molecular Weight
286.28
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(R)-Isosakuranetin

(R)-Isosakuranetin has been reported in Adenothamnus validus, Monarda didyma, and other organisms with data available.

CAS Number221362-74-9
PubChem CID1149877
IUPAC Name(2R)-5,7-dihydroxy-2-(4-methoxyphenyl)-2,3-dihydrochromen-4-one
Molecular FormulaC16H14O5
Molecular Weight286.28
XLogP2.7
Topological Polar Surface Area76
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity377
SMILES
COC1=CC=C(C=C1)[C@H]2CC(=O)C3=C(C=C(C=C3O2)O)O
InChI
InChI=1S/C16H14O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-7,14,17-18H,8H2,1H3/t14-/m1/s1
InChIKey
HMUJXQRRKBLVOO-CQSZACIVSA-N
Chemical Structure
2D Structure
2D structure of (R)-Isosakuranetin
CAS: 221362-74-9
CID: 1149877
Formula: C16H14O5
MW: 286.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight286.28
XLogP32.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass286.08412354
Monoisotopic Mass286.08412354
Topological Polar Surface Area76 Ų
Heavy Atom Count21
Formal Charge0
Complexity377
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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