5-Hydroxytryptamine-4,7-dione

Base Information

• Chemical Name: 5-Hydroxytryptamine-4,7-dione
• CAS No.: 100513-78-8
• Molecular Formula: C₁₀H₁₀N₂O₃
• Molecular Weight: 206.201
• DSSTox Substance ID: DTXSID80905564
• Nikkaji Number: J528.724C
• Wikidata: Q82874072
• ChEMBL ID: CHEMBL1160505
• Mol file: 100513-78-8.mol

Synonyms:5-HTP-4,7-dione;5-hydroxytryptamine-4,7-dione

Chemical Property of 5-Hydroxytryptamine-4,7-dione

Chemical Property:

• Vapor Pressure: 5.75E-11mmHg at 25°C
• Boiling Point: 503.7°Cat760mmHg
• Flash Point: 258.4°C
• PSA: 96.18000
• Density: 1.558g/cm³
• LogP: 0.88050
• XLogP3: -1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 206.06914219
• Heavy Atom Count: 15
• Complexity: 338

Purity/Quality:

98%min ^*data from raw suppliers

3-(2-aminoethyl)-5-hydroxy-1H-Indole-4,7-dione 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C2=C(C(=CN2)CCN)C(=O)C1=O)O

Technology Process of 5-Hydroxytryptamine-4,7-dione

There total 4 articles about 5-Hydroxytryptamine-4,7-dione 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:

5,7-dihydroxytryptamine (31363-74-3) → 5-hydroxytryptamine-4,7-dione (100513-78-8) + 6,6'-bis(5-hydroxytryptamine-4,7-dione) (124620-49-1) + 6-S-glutathionyl-5-hydroxytryptamine-4,7-dione

Guidance literature:

With GLUTATHIONE; at 37 ℃; for 18h; pH=7.4;

DOI:10.1021/jm00054a006

Reference yield:

glutathion (70-18-8) + 5,7-dihydroxytryptamine (31363-74-3) → 5-hydroxytryptamine-4,7-dione (100513-78-8) + 6,6'-bis(5-hydroxytryptamine-4,7-dione) (124620-49-1) + 6-S-glutathionyl-5-hydroxytryptamine-4,7-dione

Guidance literature:

at 37 ℃; for 18h; pH=7.4;

DOI:10.1021/jm00054a006

Reference yield:

5,7-dihydroxytryptamine (31363-74-3) → 5-hydroxytryptamine-4,7-dione (100513-78-8) + 6,6'-bis(5-hydroxytryptamine-4,7-dione) (124620-49-1) + 3-(2-aminoethyl)-6-<3-(2-aminoethyl)-1,7-dihydro-5-hydroxy-7-oxo-6H-indol-6-ylidene>-1H-indole-5,7(4H,6H)-dione (141272-05-1) + 3-(2-aminoethyl)-4-<3-(2-aminoethyl)-1,7-dihydro-5-hydroxy-7-oxo-4H-indol-4-ylidene>-1H-indole-5,7(4H,6H)-dione

Guidance literature:

With oxygen; In water; at 37 ℃; for 17.5h; Product distribution; Mechanism; pH 7.4; influence of transition metal ions and var. enzymes;

DOI:10.1021/jm00090a018

upstream raw materials:

glutathion

5,7-dihydroxytryptamine