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Tsugafolin

CAT: 0804-HY-N1116-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N1116-02Size:5 mg
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Description
Tsugafolin (compound 4) is a dehydroflavone with weak anti-HIV activity (IC50=118 μM) and devoid cytotoxicity (Vitex leptobotrys[1].
CAS Number
66568-97-6
UNSPSC
12352005
Hazard Statement
H302-H315-H319-H335
Target
HIV
Type
Natural Products
Related Pathways
Anti-infection
Applications
COVID-19-anti-virus
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/tsugafolin.html
Solubility
10 mM in DMSO
Smiles
O=C1C[C@@H](C2=CC=C(OC)C=C2)OC3=CC(O)=CC(OC)=C13
Molecular Formula
C17H16O5
Molecular Weight
300.31
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
References & Citations
[1]Tanaka R, et al. A new flavanone derivative from the leaves of Tsuga diversifolia[J]. Planta medica, 1989, 55 (06) : 570-571.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Tsugafolin

CID 45273057 has been reported in Viscum album, Carpesium lipskyi, and other organisms with data available.

CAS Number66568-97-6
PubChem CID45273057
IUPAC Name(2S)-7-hydroxy-5-methoxy-2-(4-methoxyphenyl)-2,3-dihydrochromen-4-one
Molecular FormulaC17H16O5
Molecular Weight300.30
XLogP2.5
Topological Polar Surface Area65
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity391
SMILES
COC1=CC=C(C=C1)[C@@H]2CC(=O)C3=C(O2)C=C(C=C3OC)O
InChI
InChI=1S/C17H16O5/c1-20-12-5-3-10(4-6-12)14-9-13(19)17-15(21-2)7-11(18)8-16(17)22-14/h3-8,14,18H,9H2,1-2H3/t14-/m0/s1
InChIKey
KFGFEKHSEPSVNO-AWEZNQCLSA-N
Chemical Structure
2D Structure
2D structure of Tsugafolin
CAS: 66568-97-6
CID: 45273057
Formula: C17H16O5
MW: 300.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight300.30
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass300.09977361
Monoisotopic Mass300.09977361
Topological Polar Surface Area65 Ų
Heavy Atom Count22
Formal Charge0
Complexity391
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

Alternative Products

CatalogName
TBW00555Tsugafolin

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