Isocorynoxeine

Base Information

Chemical Name:Isocorynoxeine
CAS No.:51014-29-0
Molecular Formula:C22H26N2O4
Molecular Weight:382.4528
Hs Code.:
UNII:J18B596D11
DSSTox Substance ID:DTXSID701317164
Wikidata:Q27281021
Metabolomics Workbench ID:138095
ChEMBL ID:CHEMBL481359

Synonyms:corynoxeine;corynoxeine, (16E,20alpha)-isomer;isocorynoxeine;methyl (7beta,16E,20alpha)-17-methoxy-2-oxocorynoxa-16,18-dien-16-carboxylate

Suppliers and Price of Isocorynoxeine

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
Isocorynoxeine
10mg
$ 433.00

TRC
7-Isocorynoxeine
1mg
$ 115.00

TRC
7-Isocorynoxeine
2.5mg
$ 235.00

Medical Isotopes, Inc.
Isocorynoxeine 98%
1000 mg
$ 1733.00

DC Chemicals
Isocorynoxeine >98%,StandardReferencesGrade
20 mg
$ 280.00

Crysdot
Isocorynoxeine 98+%
5mg
$ 102.00

Crysdot
Isocorynoxeine 98+%
10mg
$ 179.00

ChemScene
Isocorynoxeine 99.95%
5mg
$ 174.00

ChemScene
Isocorynoxeine 99.95%
10mg
$ 306.00

Biorbyt Ltd
Isocorynoxeine
10 mg
$ 379.10

Total 48 raw suppliers

Chemical Property of Isocorynoxeine

Chemical Property:

Vapor Pressure:1.09E-12mmHg at 25°C
Boiling Point:562.7°Cat760mmHg
PKA:13.54±0.60(Predicted)
Flash Point:294.1°C
Density:1.25g/cm³
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:382.18925731
Heavy Atom Count:28
Complexity:690

Purity/Quality:

99%, ^*data from raw suppliers

Isocorynoxeine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC=C(C1CC2C3(CCN2CC1C=C)C4=CC=CC=C4NC3=O)C(=O)OC
Isomeric SMILES:CO/C=C(\[C@H]1C[C@H]2[C@]3(CCN2C[C@@H]1C=C)C4=CC=CC=C4NC3=O)/C(=O)OC
Description The leaves of Mitragyna rotundlfolia grown in Burma have recently been found to contain this alkaloid. This is the first reported occurrence of the base in nature. The structure has been established from spectroscopic investigations.
Uses 7-Isocorynoxeine is a bioactive oxindole alkaloid in the Uncaria species. Displays wide array of beneficial cardiovascular and cardiocerebral vascular system effects.

Technology Process of Isocorynoxeine

There total 12 articles about Isocorynoxeine 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:

: C₂₀H₂₂N₂O₄

: 865-47-4
potassium tert-butylate

: 4009-98-7
(methoxymethyl)triphenylphosphonium chloride

: 630-94-4,51014-29-0
(±)-corynoxeine

Guidance literature:: potassium tert-butylate; (methoxymethyl)triphenylphosphonium chloride; In tetrahydrofuran; at 20 ℃; for 0.0833333h;

C₂₀H₂₂N₂O₄; In tetrahydrofuran; at -78 - 20 ℃;

With trifluoroacetic acid; trifluoroacetic anhydride; In dichloromethane; at 20 ℃; for 20h;
DOI:10.1002/ejoc.201201505

Reference yield:

: C₂₅H₂₉N₃O₈S

: 630-94-4,51014-29-0
(±)-corynoxeine

Guidance literature:: Multi-step reaction with 5 steps

1.1: thiophenol; potassium carbonate / dimethyl sulfoxide / 2.15 h

2.1: triethylamine / acetonitrile / 2.33 h / 20 °C

3.1: caesium carbonate; N-ethyl-N,N-diisopropylamine; 1,2-bis-(diphenylphosphino)ethane; bis(η3-allyl-μ-chloropalladium(II)) / tetrahydrofuran / 8 h / Inert atmosphere

4.1: 6 h / 0 °C

5.1: tetrahydrofuran / 0.08 h / 20 °C

5.2: -78 - 20 °C

With bis(η3-allyl-μ-chloropalladium(II)); potassium carbonate; caesium carbonate; thiophenol; triethylamine; N-ethyl-N,N-diisopropylamine; 1,2-bis-(diphenylphosphino)ethane; In tetrahydrofuran; dimethyl sulfoxide; acetonitrile; 5.2: |Wittig Olefination;
DOI:10.1002/ejoc.201201505

Reference yield:

: 1443767-64-3
C₁₉H₂₆N₂O₄

: 630-94-4,51014-29-0
(±)-corynoxeine

Guidance literature:: Multi-step reaction with 4 steps

1.1: triethylamine / acetonitrile / 2.33 h / 20 °C

2.1: caesium carbonate; N-ethyl-N,N-diisopropylamine; 1,2-bis-(diphenylphosphino)ethane; bis(η3-allyl-μ-chloropalladium(II)) / tetrahydrofuran / 8 h / Inert atmosphere

3.1: 6 h / 0 °C

4.1: tetrahydrofuran / 0.08 h / 20 °C

4.2: -78 - 20 °C

With bis(η3-allyl-μ-chloropalladium(II)); caesium carbonate; triethylamine; N-ethyl-N,N-diisopropylamine; 1,2-bis-(diphenylphosphino)ethane; In tetrahydrofuran; acetonitrile; 4.2: |Wittig Olefination;
DOI:10.1002/ejoc.201201505