Tadeonal

Base Information

Chemical Name:Tadeonal
CAS No.:6754-20-7
Molecular Formula:C15H22O2
Molecular Weight:234.338
Hs Code.:
NSC Number:372407
UNII:A00RAV0W57,5FAF7T66M7
DSSTox Substance ID:DTXSID901027214
Nikkaji Number:J20.540K
Wikipedia:Polygodial
Wikidata:Q3395581
Pharos Ligand ID:CKZ28HA2JMDC
Metabolomics Workbench ID:67886
ChEMBL ID:CHEMBL254550

Synonyms:1,4,4a,5,6,7,8,8a-octahydro-5,5,8a-trimethyl-1,2-naphthalenedicarboxaldehyde;epipolygodial;polygodial

Suppliers and Price of Tadeonal

Supply Marketing:

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

Usbiological
Polygodial
10mg
$ 423.00

TRC
Polygodial
5mg
$ 275.00

Tocris
Polygodial ≥97%(HPLC)
10
$ 181.00

Tocris
Polygodial ≥97%(HPLC)
50
$ 738.00

Sigma-Aldrich
Polygodial ≥97% (HPLC)
50mg
$ 635.00

Sigma-Aldrich
Polygodial ≥97% (HPLC)
10mg
$ 163.00

Cayman Chemical
Polygodial ≥98%
5mg
$ 82.00

Cayman Chemical
Polygodial ≥98%
1mg
$ 28.00

Cayman Chemical
Polygodial ≥98%
10mg
$ 136.00

Cayman Chemical
Polygodial ≥98%
25mg
$ 305.00

Total 12 raw suppliers

Chemical Property of Tadeonal

Chemical Property:

Vapor Pressure:0.000163mmHg at 25°C
Melting Point:57° (Barnes, Loder)
Boiling Point:330.7°Cat760mmHg
Flash Point:124°C
PSA：34.14000
Density:1.084g/cm³
LogP:3.16310
Storage Temp.:Store at -20°C
Solubility.:DMSO: soluble20mg/mL, clear
XLogP3:3.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:234.161979940
Heavy Atom Count:17
Complexity:367

Purity/Quality:

98%,99%, ^*data from raw suppliers

Polygodial ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Statements: 52/53
Safety Statements: 61

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(CCCC2(C1CC=C(C2C=O)C=O)C)C
Isomeric SMILES:C[C@]12CCCC([C@@H]1CC=C([C@@H]2C=O)C=O)(C)C
Description Polygodial (6754-20-7) is a TRPA1 activator (EC50=400 nM).1?A naturally occurring drimane sesquiterpene dialdehyde found in a variety of plant species including water pepper (Polygonum hydropiper). Polygodial has been used in folk medicine for a variety of indications. Displays analgesic activity via desensitization of sensory neurons.2
Uses Polygodial is a naturally occurring antifungal and antinociceptive.

Technology Process of Tadeonal

There total 55 articles about Tadeonal 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: 98.0%

: 34437-62-2
drimendiol

: 6754-20-7,72581-70-5
Polygodial

Guidance literature:: With oxalyl dichloride; dimethyl sulfoxide; In dichloromethane; at -60 ℃; for 2h;

Reference yield: 20.0%

: 22567-27-7,34437-62-2,79732-75-5,90581-65-0,94942-39-9,106622-50-8,146276-81-5
((1S,4aR,8aS)-2-Hydroxymethyl-5,5,8a-trimethyl-1,4,4a,5,6,7,8,8a-octahydro-naphthalen-1-yl)-methanol

: 5956-39-8,6752-77-8,6754-20-7,33118-34-2,71536-99-7,90581-66-1,90581-67-2,94372-44-8,109838-20-2,109838-21-3,119238-51-6,126188-20-3,72581-70-5
(1S,4aR,8aS)-5,5,8a-Trimethyl-1,4,4a,5,6,7,8,8a-octahydro-naphthalene-1,2-dicarbaldehyde

Guidance literature:: With dimethyl sulfoxide; triethylamine; trifluoroacetic anhydride; at -60 ℃;
DOI:10.1016/S0040-4039(01)80095-2

Reference yield:

: 71557-96-5
dimethyl 3,5,6,7,8,8a-hexahydro-5,5,8a-trimethylnaphthalene-1,2-dicarboxylate

: 5956-39-8,6752-77-8,6754-20-7,33118-34-2,71536-99-7,90581-66-1,90581-67-2,94372-44-8,109838-20-2,109838-21-3,119238-51-6,126188-20-3,72581-70-5
(1S,4aR,8aS)-5,5,8a-Trimethyl-1,4,4a,5,6,7,8,8a-octahydro-naphthalene-1,2-dicarbaldehyde

Guidance literature:: Multi-step reaction with 4 steps

1: 80 percent / 1,5 diazabicyclo<5.4.0>undecene-5 / toluene / 48 h / Heating

2: H₂ / Pd/C / methanol / 760 Torr

3: LiAlH₄

4: 20 percent / trifluoroacetic anhydride, triethylamine, DMSO / -60 °C

With lithium aluminium tetrahydride; hydrogen; dimethyl sulfoxide; triethylamine; trifluoroacetic anhydride; 1,5-Diazabicyclo[5.4.0]undec-5-ene; palladium on activated charcoal; In methanol; toluene;
DOI:10.1016/S0040-4039(01)80095-2