Cas no 34096-83-8 (Glycyrrhetic acid 3-O-β-D-glucuronide)

Glycyrrhetic acid 3-O-β-D-glucuronide is a bioactive glucuronide conjugate derived from glycyrrhetic acid, the aglycone of glycyrrhizic acid found in licorice root. This compound exhibits enhanced water solubility compared to its parent molecule, facilitating improved bioavailability and pharmacokinetic properties. It demonstrates notable anti-inflammatory and hepatoprotective effects by modulating key signaling pathways, including NF-κB and MAPK. The β-D-glucuronide moiety at the C-3 position contributes to its selective biological activity and metabolic stability. As a high-purity reference standard, it serves as a critical tool for pharmacological research, particularly in studying detoxification mechanisms and drug metabolism. Its structural specificity makes it valuable for investigating UDP-glucuronosyltransferase-mediated biotransformation processes.
Glycyrrhetic acid 3-O-β-D-glucuronide structure
34096-83-8 structure
Product Name:Glycyrrhetic acid 3-O-β-D-glucuronide
CAS No:34096-83-8
MF:C36H54O10
MW:646.8080
MDL:MFCD00210301
CID:310346
PubChem ID:14312747
Update Time:2025-07-02

Glycyrrhetic acid 3-O-β-D-glucuronide Chemical and Physical Properties

Names and Identifiers

    • b-D-Glucopyranosiduronic acid, (3b,20b)-20-carboxy-11-oxo-30-norolean-12-en-3-yl
    • Glycyrrhetic Acid 3-O-β-D-Glucuronide
    • Glycyrrhetic acid 3-O-mono-beta-D-glucuronide
    • (2S,3S,4S,5R,6R)-6-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-car
    • Glycyrrhetinic acid Monoglucuronide
    • 3-MGA
    • 3-monoglucuronylglycyrrhetinic acid
    • Glycyrrhetic Acid 3-O-Glucuronide
    • glycyrrhetic acid mono-glucuronide
    • Glycyrrhetyl 3-monoglucuronide
    • Starrhizin
    • Glycyrrhetic Acid 3-O-
    • A-D-Glucuronide
    • Glycyrrhetic acid-3-O-glucuronide
    • 3-Monoglucuronyl-glycyrrhetinic acid
    • Glycyrrhetic acid 3-O-beta-D-monoglucuronide
    • Glycyrrhetic Acid 3-O-b-D-Glucuronide
    • Glycyrrhetinic acid 3-O-mono-b-D-glucuronide
    • (3beta,20beta)-20-carboxy-11-oxo-30-norolean-12-en-3-yl beta-D-glucopyranosiduronic acid
    • 3beta-D-(Monoglucuronyl)-18beta-glycyrrhetinate
    • Glycyrrhetate 3-O-glucuronide
    • Glycyrrhetate 3-O-mono-I2-D-glucuronide
    • (2S,3S,4S,5R,6R)-6-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
    • Glycyrrhetate 3-O-b-D-glucuronide
    • 3-Monoglucuronyl glycyrrhetinate
    • Glycyrrhetinate acid 3-O-b-D-glucuronide
    • G12482
    • Glycyrrhetate 3-O-beta-D-glucuronide
    • Glycyrrhetate 3-O-mono-beta-D-glucuronide
    • 3-monoglucuronyl glycyrrhetinic acid
    • 3-(Monoglucuron-1'-yl)-18-glycyrrhetic acid
    • Glycyrrhetic acid 3-O-I2-D-glucuronide
    • Glycyrrhetic acid 3-O--D-glucuronide
    • 3-O-b-D-Glucuronopyranosyl-18b-glycyrrhetinate
    • glycyrrhetinic acid 3-O-mono-beta-D-glucuronide
    • 34096-83-8
    • 18b-Glycyrrhetinic acid-3-O-b-D-glucuronide
    • Glycyrrhetate 3-O-I2-D-glucuronide
    • 3b-D-(Monoglucuronyl)-18b-glycyrrhetinic acid
    • 3-O-beta-D-glucuronopyranosyl-18beta-glycyrrhetinic acid
    • 18b-Glycyrrhetyl-3-O-glucuronide
    • HY-N6851
    • glycyrrhetinic acid 3-O-monoglucuronide
    • Glycyrrhetinic acid 3-O-mono-I2-D-glucuronide
    • glycyrrhetinic acid 3-O-glucuronide
    • AKOS027382832
    • (3beta,20beta)-20-Carboxy-11-oxo-30-norolean-12-en-3-yl beta-D-glucopyranosiduronate
    • 1-(18beta-Glycyrrhet-3-yl)glucopyranuronic acid
    • Glycyrrhetinate acid 3-O-I2-D-glucuronide
    • (3b,20b)-20-Carboxy-11-oxo-30-norolean-12-en-3-yl b-D-glucopyranosiduronic acid
    • (2S,3S,4S,5R,6R)-6-{[(3S,4AR,6AR,6BS,8AS,11S,12AR,14AR,14BS)-11-CARBOXY-4,4,6A,6B,8A,11,14B-HEPTAMETHYL-14-OXO-2,3,4A,5,6,7,8,9,10,12,12A,14A-DODECAHYDRO-1H-PICEN-3-YL]OXY}-3,4,5-TRIHYDROXYOXANE-2-CARBOXYLIC ACID
    • Glycyrrhetinate 3-O-monoglucuronide
    • CHEBI:189708
    • 3beta-D-(Monoglucuronyl)-18beta-glycyrrhetinic acid
    • Glycyrrhetinate 3-O-mono-I2-D-glucuronide
    • glycyrrhetinic acid acid 3-O-beta-D-glucuronide
    • 3-O-beta-D-Glucuronopyranosyl-18beta-glycyrrhetinate
    • Glycyrrhetinate 3-O-mono-beta-D-glucuronide
    • beta-D-Glucopyranosiduronic acid, (3beta,20beta)-20-carboxy-11-oxo-30-norolean-12-en-3-yl
    • FJL
    • 29-Hydroxy-11,29-dioxoolean-12-en-3-yl hexopyranosiduronic acid
    • Glycyrrhetic acid 3-O-mono-I2-D-glucuronide
    • Glycyrrhetic acid 3-O-beta-D-glucuronide
    • 3b-D-(Monoglucuronyl)-18b-glycyrrhetinate
    • Glycyrrhetinic acid acid 3-O-I2-D-glucuronide
    • 18beta-Glycyrrhetinate-3-O-beta-D-glucuronide
    • Glycyrrhetic acid 3-O-mono-b-D-glucuronide
    • (2S,3S,4S,5R,6R)-6-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
    • Glycyrrhetinate acid 3-O-beta-D-glucuronide
    • 3-O-Glucuronopyranosylglycyrrhetinic acid
    • 3-O-Glucuronopyranosylglycyrrhetinate
    • DTXSID70955639
    • 18beta-glycyrrhetyl-3-O-glucuronide
    • Glycyrrhetate 3-O-mono-b-D-glucuronide
    • (2~{S},3~{S},4~{S},5~{R},6~{R})-6-[[(3~{S},4~{a}~{R},6~{a}~{R},6~~{S},8~{a}~{S},11~{S},12~{a}~{R},14~{a}~{R},14~~{S})-11-carboxy-4,4,6~{a},6~,8~{a},11,14~-heptamethyl-14-oxidanylidene-2,3,4~{a},5,6,7,8,9,10,12,12~{a},14~{a}-dodecahydro-1~{H}-picen-3-yl]oxy]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid
    • 18beta-glycyrrhetinic acid-3-o-beta-d-glucuronide
    • 30-hydroxy-11,30-dioxoolean-12-en-3beta-yl beta-D-glucopyranosiduronic acid
    • 3-O-b-D-Glucuronopyranosyl-18b-glycyrrhetinic acid
    • CS-0100277
    • 18b-Glycyrrhetinate-3-O-b-D-glucuronide
    • MS-30945
    • Glycyrrhetinic acid acid 3-O-b-D-glucuronide
    • Glycyrrhetinate 3-O-mono-b-D-glucuronide
    • 3-Monoglucuronyl-glycyrrhetinate
    • Glycyrrhetinate 3-O-glucuronide
    • (3b,20b)-20-Carboxy-11-oxo-30-norolean-12-en-3-yl b-D-glucopyranosiduronate
    • Glycyrrhetic acid 3-O-β-D-glucuronide
    • MDL： MFCD00210301
    • Inchi： 1S/C36H54O10/c1-31(2)21-8-11-36(7)27(34(21,5)10-9-22(31)45-29-25(40)23(38)24(39)26(46-29)28(41)42)20(37)16-18-19-17-33(4,30(43)44)13-12-32(19,3)14-15-35(18,36)6/h16,19,21-27,29,38-40H,8-15,17H2,1-7H3,(H,41,42)(H,43,44)/t19-,21-,22-,23-,24-,25+,26-,27+,29+,32+,33-,34-,35+,36+/m0/s1
    • InChI Key： HLDYLAJAWSKPFZ-QDPIGISRSA-N
    • SMILES： O([C@@]1([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C(=O)O[H])O1)O[H])O[H])O[H])[C@@]1([H])C([H])([H])C([H])([H])[C@@]2(C([H])([H])[H])[C@@]([H])(C([H])([H])C([H])([H])[C@@]3(C([H])([H])[H])[C@]4(C([H])([H])[H])C([H])([H])C([H])([H])[C@@]5(C([H])([H])[H])C([H])([H])C([H])([H])[C@@](C(=O)O[H])(C([H])([H])[H])C([H])([H])[C@@]5([H])C4=C([H])C([C@@]32[H])=O)C1(C([H])([H])[H])C([H])([H])[H]

Computed Properties

  • Exact Mass: 646.37200
  • Monoisotopic Mass: 646.37169792 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 10
  • Heavy Atom Count: 46
  • Rotatable Bond Count: 4
  • Complexity: 1340
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 14
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 171
  • Molecular Weight: 646.8
  • XLogP3: 5.1

Experimental Properties

  • Color/Form: Powder
  • Density: 1.31±0.1 g/cm3 (20 oC 760 Torr),
  • Melting Point: >200oC (dec.)
  • Boiling Point: 785.0±60.0 °C at 760 mmHg
  • Flash Point: 240.7±26.4 °C
  • Refractive Index: 1.595
  • Solubility: Insuluble (1.9E-3 g/L) (25 oC),
  • PSA: 170.82000
  • LogP: 4.32910
  • Vapor Pressure: 0.0±6.2 mmHg at 25°C

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Glycyrrhetic acid 3-O-β-D-glucuronide Production Method

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Amadis Chemical Company Limited
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(CAS:34096-83-8)Glycyrrhetic acid 3-O-β-D-glucuronide
Order Number:A1202701
Stock Status:in Stock
Quantity:20mg
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 02:48
Price ($):313.0

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Amadis Chemical Company Limited
(CAS:34096-83-8)Glycyrrhetic acid 3-O-β-D-glucuronide
A1202701
Purity:99%
Quantity:20mg
Price ($):313.0
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