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Kadsurenin B

CAT: 0804-HY-N11920-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N11920-01Size:1 mg
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Description
Kadsurenin B is a PAF (platelet-activating factor) antagonist with neuroprotective activity. Kadsurenin B has a wide range of pharmacological research potential, such as antibacterial, anti-inflammatory, neuroprotective, antioxidant, antiplatelet aggregation, cytotoxic, antiparasitic, etc[1][2].
CAS Number
145701-13-9
UNSPSC
12352005
Target
Platelet-activating Factor Receptor (PAFR)
Type
Natural Products
Related Pathways
GPCR/G Protein
Applications
COVID-19-immunoregulation
Field of Research
Infection; Inflammation/Immunology; Neurological Disease
Assay Protocol
https://www.medchemexpress.com/kadsurenin-b.html
Solubility
10 mM in DMSO
Smiles
CO[C@@]([C@@H]1O)(C=C2CC=C)[C@@H]([C@@H](C3=CC=C4C(OCO4)=C3)[C@]1([H])C2=O)C
Molecular Formula
C20H22O5
Molecular Weight
342.39
References & Citations
[1]Ma Y, et al. Studies on PAF antagonistic bicyclo (3,2,1) octanoid neolignans from Piper kadsura. Yao Xue Xue Bao. 1993;28 (3) :207-11. |[2]Fan D, et al. Lignans from the genus Piper L. and their pharmacological activities: An updated review. Fitoterapia. 2023 Mar;165:105403.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

(1S,5R,6R,7R)-7-(1,3-benzodioxol-5-yl)-8-hydroxy-5-methoxy-6-methyl-3-prop-2-enylbicyclo[3.2.1]oct-3-en-2-one
CAS Number145701-13-9
PubChem CID102481771
IUPAC Name(1S,5R,6R,7R)-7-(1,3-benzodioxol-5-yl)-8-hydroxy-5-methoxy-6-methyl-3-prop-2-enylbicyclo[3.2.1]oct-3-en-2-one
Molecular FormulaC20H22O5
Molecular Weight342.4
XLogP2.4
Topological Polar Surface Area65
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count25
Formal Charge0
Complexity599
SMILES
C[C@@H]1[C@H]([C@H]2C([C@@]1(C=C(C2=O)CC=C)OC)O)C3=CC4=C(C=C3)OCO4
InChI
InChI=1S/C20H22O5/c1-4-5-13-9-20(23-3)11(2)16(17(18(13)21)19(20)22)12-6-7-14-15(8-12)25-10-24-14/h4,6-9,11,16-17,19,22H,1,5,10H2,2-3H3/t11-,16+,17-,19?,20+/m1/s1
InChIKey
ARFBOYDNJXQGTO-ARQBSGROSA-N
Chemical Structure
2D Structure
2D structure of (1S,5R,6R,7R)-7-(1,3-benzodioxol-5-yl)-8-hydroxy-5-methoxy-6-methyl-3-prop-2-enylbicyclo[3.2.1]oct-3-en-2-one
CAS: 145701-13-9
CID: 102481771
Formula: C20H22O5
MW: 342.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight342.4
XLogP32.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass342.14672380
Monoisotopic Mass342.14672380
Topological Polar Surface Area65 Ų
Heavy Atom Count25
Formal Charge0
Complexity599
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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