Cas no 198976-06-6 (Dihydro Artemisinin β-D-Glucuronide (Mixture of Isomers))

Dihydro Artemisinin β-D-Glucuronide (Mixture of Isomers) is a glucuronide conjugate of dihydroartemisinin, a key metabolite of artemisinin derivatives. This compound is of interest in pharmacological and metabolic studies due to its role in the biotransformation of artemisinin-based drugs. The β-D-glucuronide moiety enhances solubility, facilitating excretion and metabolic clearance. As a mixture of isomers, it provides a representative model for investigating stereoselective metabolism and pharmacokinetics. Its structural features make it valuable for analytical reference standards, drug metabolism research, and the development of antimalarial therapies. The product is characterized by high purity and stability, ensuring reliability for research applications in medicinal chemistry and pharmacokinetics.
Dihydro Artemisinin β-D-Glucuronide (Mixture of Isomers) structure
198976-06-6 structure
Product Name:Dihydro Artemisinin β-D-Glucuronide (Mixture of Isomers)
CAS No:198976-06-6
MF:C21H32O11
MW:460.472187995911
MDL:MFCD08063733
CID:908619
PubChem ID:71433639
Update Time:2025-05-28

Dihydro Artemisinin β-D-Glucuronide (Mixture of Isomers) Chemical and Physical Properties

Names and Identifiers

    • dihydro-artemisinin glucuronide
    • DIHYDRO ARTEMISININ B-D-GLUCURONIDE (MIXTURE OF ISOMERS)
    • Dihydro Artemisinin β-D-Glucuronide
    • Dihydro Artemisinin β-D-Glucuronide (Mixture of Isomers)
    • Dihydro Artemisinin -D-Glucuronide (Mixture of Isomers)
    • (3R,5aS,6R,8aS,9S,12R,12aS)-Decahydro-3,6,9-trimethyl- 3,12-epoxy-12H-pyrano[4,3-j]-1,2-benzodioxepin-10-yl -D-Glucopyranosiduronic Acid
    • (3R,5aS,6R,8aS,9S,12R,12aS)-Decahydro-3,6,9-trimethyl- 3,12-epoxy-12H-pyrano[4,3-j]-1,2-benzodioxepin-10-yl b-D-Glucopyranosiduronic Acid
    • 3,4,5-trihydroxy-6-[(1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-yl)oxy]oxane-2-carboxylic acid
    • 198976-06-6
    • 157468-39-8
    • 12a-1'b-Dihydroartemisinin glucuronide
    • J-012853
    • AKOS025294836
    • 1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadec-10-yl hexopyranosiduronic acid
    • DTXSID50875346
    • MDL: MFCD08063733
    • Inchi: 1S/C21H32O11/c1-8-4-5-11-9(2)17(28-18-14(24)12(22)13(23)15(27-18)16(25)26)29-19-21(11)10(8)6-7-20(3,30-19)31-32-21/h8-15,17-19,22-24H,4-7H2,1-3H3,(H,25,26)
    • InChI Key: ZPXMEOGHWWIMAF-UHFFFAOYSA-N
    • SMILES: O1C23C4OC(C(C)C2CCC(C)C3CCC(C)(O1)O4)OC1C(C(C(C(C(=O)O)O1)O)O)O

Computed Properties

  • Exact Mass: 460.19400
  • Monoisotopic Mass: 460.19446183g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 11
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 3
  • Complexity: 749
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 13
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.2
  • Topological Polar Surface Area: 153?2

Experimental Properties

  • Density: 1.5±0.1 g/cm3
  • Melting Point: 103-109°C
  • Boiling Point: 634.5±55.0 °C at 760 mmHg
  • Flash Point: 218.2±25.0 °C
  • Solubility: Methanol, Water
  • PSA: 153.37000
  • LogP: 0.10320
  • Vapor Pressure: 0.0±4.2 mmHg at 25°C

Dihydro Artemisinin β-D-Glucuronide (Mixture of Isomers) Security Information

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Dihydro Artemisinin β-D-Glucuronide (Mixture of Isomers) Suppliers

Amadis Chemical Company Limited
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(CAS:198976-06-6)Dihydro Artemisinin β-D-Glucuronide (Mixture of Isomers)
Order Number:A1146557
Stock Status:in Stock
Quantity:1mg/2mg/5mg
Purity:99%
Pricing Information Last Updated:Thursday, 29 August 2024 23:04
Price ($):333.0/556.0/1067.0

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Amadis Chemical Company Limited
(CAS:198976-06-6)Dihydro Artemisinin β-D-Glucuronide (Mixture of Isomers)
A1146557
Purity:99%/99%/99%
Quantity:1mg/2mg/5mg
Price ($):333.0/556.0/1067.0
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