Pelargonidin chloride

Base Information

• Chemical Name: Pelargonidin chloride
• CAS No.: 134-04-3
• Molecular Formula: C15H11 O5 . Cl
• Molecular Weight: 306.702
• Hs Code.: 2906299090
• European Community (EC) Number: 205-127-7
• UNII: DFL6200791
• DSSTox Substance ID: DTXSID001020859
• Wikipedia: Pelargonidin
• Wikidata: Q27103746
• Pharos Ligand ID: UMTR7CPQKZ4Y
• Metabolomics Workbench ID: 143181
• ChEMBL ID: CHEMBL591036
• Mol file: 134-04-3.mol

Synonyms:3,5,7-trihydroxy-2-(4-hydroxyphenyl)-1-benzopyrylium;3,5,7-trihydroxy-2-(4-hydroxyphenyl)-1-benzopyrylium chloride;pelargonidin;pelargonidin chloride;pelargonidine

Chemical Property of Pelargonidin chloride

Chemical Property:

• Melting Point: >349.85°C
• Refractive Index: 1.4429 (estimate)
• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 94.06000
• Density: g/cm³
• LogP: 0.20730
• Storage Temp.: 2-8°C
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 306.0295011
• Heavy Atom Count: 21
• Complexity: 328

Purity/Quality:

≥98% ^*data from raw suppliers

Pelargonidin ^*data from reagent suppliers

Safty Information:

• Pictogram(s): UN NO.
• Hazard Codes: UN NO.
• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC(=CC=C1C2=[O+]C3=CC(=CC(=C3C=C2O)O)O)O.[Cl-]
• Uses: The aglucone of Pelargonin. Pelargonidin, an anthocyanidin, was tested for its antidiabetic potential Pelargonidin chloride can be involved in pharmacological studies investigating the use of flavonoids as inhibitors of CD381Antioxidant and anthocyanidin; founded in various natural sources evaluated for inhibitory effects on colon and liver cancer cells ; used as hyroperoxide and hydrogen peroxide scavenging substance3; and used to study relationship between structure, antioxidant capacity and redox potentials. The aglucone of Pelargonin. Pelargonidin, an anthocyanidin, was tested for its antidiabetic potential.

Technology Process of Pelargonidin chloride

There total 17 articles about Pelargonidin chloride 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:

kaempferol (520-18-3) → pelargonidin chloride (134-04-3)

Guidance literature:

With lithium aluminium tetrahydride; diethyl ether; anschliessendes Behandeln mit wss. Salzsaeure;

DOI:10.1038/166997b0

Reference yield:

hydrogenchloride (7647-01-0,15364-23-5) + ethanol (64-17-5) + (2R)-2r-(4-Hydroxy-phenyl)-chroman-3t,4ξ,5,7-tetraol (520-17-2,7431-62-1,98919-66-5,149820-46-2) → pelargonidin chloride (134-04-3)

Guidance literature:

DOI:10.1039/jr9610002787

Reference yield:

hydrogenchloride (7647-01-0,15364-23-5) + 2,3,5,7-tetraacetoxy-2-(4-acetoxy-phenyl)-2H-chromene (102891-68-9) + butan-1-ol (71-36-3) → pelargonidin chloride (134-04-3)

Guidance literature:

upstream raw materials:

kaempferol

hydrogenchloride

ethanol

(2R)-2r-(4-Hydroxy-phenyl)-chroman-3t,4ξ,5,7-tetraol

Downstream raw materials:

4-hydroxy-benzoic acid

3,5-dihydroxyphenol

3,4-Dihydroxybenzoic acid

pelargonidin-3-O-glucoside

Refernces

• 1、 Kraus, Michael,Biskup, Ellen,Richling, Elke,Schreier, Peter. "Synthesis of [4-14C]-pelargonidin chloride and [4- 14C]-delphinidin chloride". . p. 1151 - 1162. Retrieved 2007/10/03.