Cas no 136133-08-9 (Ellagic acid 7-O-beta-D-xylopyranoside-2,3,8-trimethyl ether)

Ellagic acid 7-O-beta-D-xylopyranoside-2,3,8-trimethyl ether is a chemically modified derivative of ellagic acid, characterized by the addition of a beta-D-xylopyranosyl group at the 7-position and methyl ether groups at the 2, 3, and 8 positions. This structural modification enhances its solubility and stability compared to the parent compound, making it more suitable for research applications in medicinal chemistry and pharmacology. The compound exhibits potential bioactivity due to its ellagic acid core, which is known for antioxidant and anti-inflammatory properties. Its defined structure allows for precise mechanistic studies, particularly in exploring structure-activity relationships in natural product derivatives.
Ellagic acid 7-O-beta-D-xylopyranoside-2,3,8-trimethyl ether structure
136133-08-9 structure
Product Name:Ellagic acid 7-O-beta-D-xylopyranoside-2,3,8-trimethyl ether
CAS No:136133-08-9
MF:C22H20O12
MW:476.387007713318
CID:836897
PubChem ID:10838304
Update Time:2025-06-09

Ellagic acid 7-O-beta-D-xylopyranoside-2,3,8-trimethyl ether Chemical and Physical Properties

Names and Identifiers

    • Ellagic acid 7-O-beta-D-xylopyranoside-2,3,8-trimethyl ether
    • 3,7,8-Trimethoxy-5,10-dioxo-5,10-dihydrochromeno[5,4,3-cde]chrome n-2-yl β-D-xylopyranoside
    • 3,7-DI-OMETHYLDUCHESIDE A
    • 3,7-Di-O-methylducheside A
    • [ "3", "7", "8-Tri-O-methylellagic acid 2-O-xyloside" ]
    • 3
    • CHEMBL490314
    • CS-0017650
    • HY-N1797
    • [1]Benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione,2,3,8-trimethoxy-7-(-D-xylopyranosyloxy)-
    • AKOS032948689
    • 6,7,14-trimethoxy-13-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione
    • 136133-08-9
    • FS-10316
    • DA-69897
    • 6,7,14-TRIMETHOXY-13-{[(2S,3R,4S,5R)-3,4,5-TRIHYDROXYOXAN-2-YL]OXY}-2,9-DIOXATETRACYCLO[6.6.2.0?,(1)?.0(1)(1),(1)?]HEXADECA-1(15),4,6,8(16),11,13-HEXAENE-3,10-DIONE
    • Inchi： 1S/C22H20O12/c1-28-10-4-7-12-13-8(21(27)33-18(12)16(10)29-2)5-11(17(30-3)19(13)34-20(7)26)32-22-15(25)14(24)9(23)6-31-22/h4-5,9,14-15,22-25H,6H2,1-3H3/t9-,14+,15-,22+/m1/s1
    • InChI Key： QXQRDKINPINYFD-SCBIHCBJSA-N
    • SMILES： O1C[C@H]([C@@H]([C@H]([C@@H]1OC1C=C2C(=O)OC3=C(C(=CC4C(=O)OC(C=1OC)=C2C=43)OC)OC)O)O)O

Computed Properties

  • Exact Mass: 476.09500
  • Monoisotopic Mass: 476.09547607g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 12
  • Heavy Atom Count: 34
  • Rotatable Bond Count: 5
  • Complexity: 792
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.3
  • Topological Polar Surface Area: 159?2

Experimental Properties

  • Color/Form: Powder
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 804.2±65.0 °C at 760 mmHg
  • Flash Point: 283.0±27.8 °C
  • PSA: 167.26000
  • LogP: 0.33400
  • Vapor Pressure: 0.0±3.0 mmHg at 25°C

Ellagic acid 7-O-beta-D-xylopyranoside-2,3,8-trimethyl ether Security Information

Ellagic acid 7-O-beta-D-xylopyranoside-2,3,8-trimethyl ether Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI TAO SHU Biotechnology Co., Ltd.
TN5641-5 mg
3,7-Di-O-methylducheside A
 136133-08-9
5mg
 ￥5365.00 2022-04-26
TargetMol Chemicals
TN5641-5mg
3,7-Di-O-methylducheside A
 136133-08-9
5mg
 ￥ 3940 2024-07-24
TargetMol Chemicals
TN5641-1 ml * 10 mm
3,7-Di-O-methylducheside A
 136133-08-9
1 ml * 10 mm
 ￥ 4040 2024-07-24
TargetMol Chemicals
TN5641-1 ml * 10 mm
3,7-Di-O-methylducheside A
 136133-08-9
1 ml * 10 mm
 ￥ 4040 2024-07-20
A2B Chem LLC
AE41463-5mg
3,7-Di-O-methylducheside A
 136133-08-9 Powder
5mg
 $702.00 2024-04-20
TargetMol Chemicals
TN5641-5 mg
3,7-Di-O-methylducheside A
 136133-08-9 98%
5mg
 ￥ 3,940 2023-07-11
SHANG HAI TAO SHU Biotechnology Co., Ltd.
TN5641-1 mL * 10 mM (in DMSO)
3,7-Di-O-methylducheside A
 136133-08-9
1 mL * 10 mM (in DMSO)
 ￥ 4040 2023-09-08
TargetMol Chemicals
TN5641-5mg
3,7-Di-O-methylducheside A
 136133-08-9
5mg
 ￥ 3940 2024-07-20

Ellagic acid 7-O-beta-D-xylopyranoside-2,3,8-trimethyl ether Related Literature

Related Categories

136133-08-9 (Ellagic acid 7-O-beta-D-xylopyranoside-2,3,8-trimethyl ether) Related Products

Recommended suppliers
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jinta Yudi Pharmaceutical Technology Co., Ltd.
上海嶸奧生物技術(shù)有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
上海嶸奧生物技術(shù)有限公司
Shenzhen GeneSeqTools Bioscience & Technology Co. Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shenzhen GeneSeqTools Bioscience & Technology Co. Ltd.
Yunnanjiuzhen
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Yunnanjiuzhen