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Tuberosin

CAT: 0013-GTR19180514Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19180514Size:5 mg
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Description
Tuberosin is a bioactive small molecule exhibiting anti-inflammatory and antioxidant properties. It acts as a potent, dose-dependent inhibitor of yeast α-glucosidase, making it a candidate for research in metabolic disorders and oxidative stress-related studies in vitro.
CAS Number
41347-45-9
Field of Research
Immunology & Inflammation, Metabolism Research
Smiles
[H][C@]12Oc3cc4OC (C) (C) C=Cc4cc3[C@@]1 (O) COc1cc (O) ccc21
Molecular Formula
C20H18O5
Molecular Weight
338.359
References & Citations
Jorge A Belgodere 1 2 3, Jack R Elliott 1, Megan C Benz 1, G Wills Kpeli 4, Steven Elliott 1, Isaac J Ponder 2, Geoffroy E R Sanga Pema 1, Peng Ma 5, Sophie R Dietrich 1, Thomas Cheng 1, Khoa Nguyen 1, Syreeta L Tilghman 6, Binghao Zou 7, Muralidharan Anbalagan 3 7, Brian G Rowan 3 7, Robert H Newman 8, Mark Mondrinos 3 4, Jayalakshmi Sridhar 9, Thomas E Wiese 5, Simak Ali 10, Van T Hoang 1 3, Bridgette M Collins-Burow 1 3, Elizabeth C Martin 1 3, Hamed K Abbas 11, Stephen M Boué 12, Matthew E Burow Modulation of Estrogen Receptor Activity by the Phytoalexin Tuberosin Produced from Elicited Kudzu (Pueraria lobata) J Nat Prod ., (2025)
Pubmed id
40540322
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Tuberosin

Tuberosin is a flavonoid and a pterocarpan.

CAS Number41347-45-9
PubChem CID14630495
IUPAC Name7,7-dimethyl-8,12,20-trioxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-2(11),3,5,9,14(19),15,17-heptaene-1,17-diol
Molecular FormulaC20H18O5
Molecular Weight338.4
XLogP2.5
Topological Polar Surface Area68.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count0
Heavy Atom Count25
Formal Charge0
Complexity574
SMILES
CC1(C=CC2=CC3=C(C=C2O1)OC4C3(COC5=C4C=CC(=C5)O)O)C
InChI
InChI=1S/C20H18O5/c1-19(2)6-5-11-7-14-17(9-15(11)25-19)24-18-13-4-3-12(21)8-16(13)23-10-20(14,18)22/h3-9,18,21-22H,10H2,1-2H3
InChIKey
ZBTYHECJEINCMD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tuberosin
CAS: 41347-45-9
CID: 14630495
Formula: C20H18O5
MW: 338.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight338.4
XLogP32.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count0
Exact Mass338.11542367
Monoisotopic Mass338.11542367
Topological Polar Surface Area68.2 Ų
Heavy Atom Count25
Formal Charge0
Complexity574
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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