Arisanschinin K

Base Information

• Chemical Name: Arisanschinin K
• CAS No.: 58546-56-8
• Molecular Formula: C₃₀H₃₂O₉
• Molecular Weight: 536.579
• Hs Code.: 29329990
• NSC Number: 330516
• Wikidata: Q105271373
• Metabolomics Workbench ID: 124226
• ChEMBL ID: CHEMBL1704343
• Mol file: 58546-56-8.mol

Synonyms:SCHISANTERIN A;Arisanschinin K;Schizantherin A;NSC330516;Schisantherin;129445-43-8;Schisantherin A,(S);CHEMBL1704343;HMS3885I10;Schisantherin A, >=98% (HPLC);s3880;AKOS040760696;CCG-208608;NSC-330516;NCGC00163664-01;Gomisin, 98%, from Schisandra chinensis;LS-15282;NCI60_002892;FT-0686703;FT-0775350;SR-05000002172;Q-100675;SR-05000002172-2;6-Hydroxy-1,2,3,13-tetramethoxy-6,7-dimethyl-5,6,7,8-tetrahydrobenzo[3,4]cycloocta[1,2-f][1,3]benzodioxol-5-yl benzoate #;Benzo[3,2-f][1,3]benzodioxole-5,6-diol, 5,6,7,8-tetrahydro-1,2,3,13-tetramethoxy-6,7-dimethyl-, 5-benzoate, stereoisomer

Chemical Property of Arisanschinin K

Chemical Property:

• Vapor Pressure: 3.54E-19mmHg at 25°C
• Melting Point: 110～112℃
• Refractive Index: 1.622
• Boiling Point: 675.636 °C at 760 mmHg
• PKA: 13.70±0.60(Predicted)
• Flash Point: 218.946 °C
• PSA: 101.91000
• Density: 1.338 g/cm³
• LogP: 4.95800
• Storage Temp.: Inert atmosphere,Store in freezer, under -20°C
• Solubility.: Chloroform (Slightly), Methanol (Slightly, Sonicated)
• XLogP3: 5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 7
• Exact Mass: 536.20463259
• Heavy Atom Count: 39
• Complexity: 833

Purity/Quality:

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

Schisantherin A ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC2=CC3=C(C(=C2C4=C(C(=C(C=C4C(C1(C)O)OC(=O)C5=CC=CC=C5)OC)OC)OC)OC)OCO3
• Uses: Schisantherin A?is a ligand from Schisandra chinensis. It is capable of?suppressing interleukin-1β-induced inflammation in human chondrocytes by inhibiting NF-κB and MAPKs activation.