n-cis-Feruloyltyramine

Base Information

• Chemical Name: n-cis-Feruloyltyramine
• CAS No.: 80510-09-4
• Molecular Formula: C₁₈H₁₉NO₄
• Molecular Weight: 313.353
• DSSTox Substance ID: DTXSID101313914
• Nikkaji Number: J764.132J
• Metabolomics Workbench ID: 47323
• ChEMBL ID: CHEMBL451720
• Mol file: 80510-09-4.mol

Synonyms:n-cis-feruloyltyramine;cis-N-Feruloyltyramine;80510-09-4;N-Cis-Feruloyl Tyramine;(Z)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide;2-Propenamide, 3-(4-hydroxy-3-methoxyphenyl)-N-(2-(4-hydroxyphenyl)ethyl)-, (2Z)-;CHEMBL451720;SCHEMBL17693085;CHEBI:185384;DTXSID101313914;AKOS025287954;(2Z)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide

Chemical Property of n-cis-Feruloyltyramine

Chemical Property:

• Vapor Pressure: 3.78E-15mmHg at 25°C
• Melting Point: 128-132℃ (chloroform methanol )
• Boiling Point: 603.3°Cat760mmHg
• PKA: 9.83±0.31(Predicted)
• Flash Point: 318.7°C
• PSA: 78.79000
• Density: 1.248g/cm³
• LogP: 2.86940
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 313.13140809
• Heavy Atom Count: 23
• Complexity: 391

Purity/Quality:

>=95% ^*data from raw suppliers

cis-N-Feruloyltyramine 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)O
• Isomeric SMILES: COC1=C(C=CC(=C1)/C=C\C(=O)NCCC2=CC=C(C=C2)O)O

Technology Process of n-cis-Feruloyltyramine

There total 1 articles about n-cis-Feruloyltyramine 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:

(E)-N-feruloyltyramine (66648-43-9) → (Z)-N-feruloyltyramine (65646-26-6,66648-43-9,80510-09-4)

Guidance literature:

In methanol; for 2h; Yield given; Ambient temperature; Irradiation;

Reference yield: 20.0%

(Z)-N-feruloyltyramine (65646-26-6,66648-43-9,80510-09-4) → trans-grossamide (80510-06-1,187655-56-7)

Guidance literature:

With dihydrogen peroxide; at 38 ℃; for 18h; peroxidase, phosphate buffer sulution (pH 7.38);

Reference yield:

(Z)-N-feruloyltyramine (65646-26-6,66648-43-9,80510-09-4) → (E)-N-feruloyltyramine (66648-43-9)

Guidance literature:

In methanol; for 96h; Kinetics; UV-irradiation;

DOI:10.3390/molecules21070865

upstream raw materials:

(E)-N-feruloyltyramine

Downstream raw materials:

trans-grossamide

dihydrogrossamide

(E)-N-feruloyltyramine

Refernces

• 1、 Yoshihara, Teruhiko,Yamaguchi, Katsuyoshi,Takamatsu, Seiji,Sakamura, Sadao. "A New Lignan Amide, Grossamide, from Bell Pepper (Capsicum annuum var. grossum)". . p. 2593 - 2598. Retrieved 2007/10/02.