Panduratin A

Base Information Edit

Chemical Name:Panduratin A
CAS No.:89837-52-5
Molecular Formula:C26H30O4
Molecular Weight:406.522
Hs Code.:
UNII:27N2BIM2CR
DSSTox Substance ID:DTXSID20237917
Nikkaji Number:J1.545.136J
Wikidata:Q27135347
Metabolomics Workbench ID:133202
ChEMBL ID:CHEMBL379110
Mol file:89837-52-5.mol

Synonyms:panduratin A

Suppliers and Price of Panduratin A

Supply Marketing:Edit

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
(±)-PanduratinA
10mg
$ 1320.00

Total 29 raw suppliers

Chemical Property of Panduratin A Edit

Chemical Property:

Melting Point:51 - 76°C
PSA：66.76000
Density:1.128
LogP:6.01160
Storage Temp.:-20°C, Inert atmosphere
Solubility.:Chloroform (Slightly), Methanol (Slightly)
XLogP3:6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:406.21440943
Heavy Atom Count:30
Complexity:629

Purity/Quality:

98%Min ^*data from raw suppliers

(±)-PanduratinA ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CCC(C(C1CC=C(C)C)C(=O)C2=C(C=C(C=C2O)OC)O)C3=CC=CC=C3
Isomeric SMILES:CC1=CC[C@H]([C@@H]([C@@H]1CC=C(C)C)C(=O)C2=C(C=C(C=C2O)OC)O)C3=CC=CC=C3
Uses (±)-Panduratin A (>80%) has antioxidant, anti-inflammatory and anti-allergic activities.

Technology Process of Panduratin A

There total 2 articles about Panduratin A which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 3779-61-1,1856-63-9
trans ocimene

: 2'-hydroxy-4'-methoxy-6'-ethoxymethoxychalcone

: (1'R,2'S,6'R)-(2,6-dihydroxy-4-methoxyphenyl)-(3'-methyl-1'-phenyl-2'-prenylcyclohex-3'-enyl)methanone

: 89837-52-5
Panduratin A

Guidance literature:: trans ocimene; 2'-hydroxy-4'-methoxy-6'-ethoxymethoxychalcone; at 150 ℃; for 24h; Inert atmosphere;

With hydrogenchloride; In methanol; water; at 80 ℃; for 0.166667h; Inert atmosphere;
DOI:10.1016/j.tetlet.2009.11.030

Reference yield:

: 3779-61-1,1856-63-9
trans ocimene

: 1040406-79-8
2'-hydroxy-4'-methoxy-6'-acetoxychalcone

: (+/-)-(1'R,2'R,6'R)-(2,6-dihydroxy-4-methoxyphenyl)-(3'-methyl-6'-phenyl-2'-prenylcyclohex-3'-enyl)methanone

: 89837-52-5
Panduratin A

Guidance literature:: trans ocimene; 2'-hydroxy-4'-methoxy-6'-acetoxychalcone; In dichloromethane; at 50 ℃; for 48h;

With sodium hydrogencarbonate; In methanol; water; at 40 ℃; for 6h;
DOI:10.1021/ja102482b