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Glycyrrhizin

Molecular FormulaC₄₂H₆₂O₁₆
Average mass822.932 Da
Monoisotopic mass822.403809 Da
ChemSpider ID14263

- 19 of 19 defined stereocentres

More details:

Names and Synonyms
Database ID(s)

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3b,20b)-20-Carboxy-11-oxo-30-norolean-12-en-3-yl 2-O-b-D-Glucopyranuronosyl-a-D-glucopyranosiduronic Acid

(3β)-30-Hydroxy-11,30-dioxoolean-12-en-3-yl 2-O-β-D-glucopyranuronosyl-α-D-glucopyranosiduronic acid [ACD/IUPAC Name]

(3β)-30-Hydroxy-11,30-dioxoolean-12-en-3-yl-2-O-β-D-glucopyranuronosyl-α-D-glucopyranosiduronsäure [German] [ACD/IUPAC Name]

1405-86-3 [RN]

20b-Carboxy-11-oxo-30-norolean-12-en-3b-yl-2-O-b-D-glucopyranuronosyl-a-D-glucopyranosiduronic Acid

215-785-7 [EINECS]

Acide 2-O-β-D-glucopyranuronosyl-α-D-glucopyranosiduronique de (3β)-30-hydroxy-11,30-dioxooléan-12-én-3-yle [French] [ACD/IUPAC Name]

Glycyrrhizate

Glycyrrhizic acid

Glycyrrhizin [JAN] [Wiki]

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glycyrrhizinic acid

MFCD00065194 [MDL number]

Olean-12-en-30-oic acid, 3-[(2-O-β-D-glucopyranuronosyl-α-D-glucopyranuronosyl)oxy]-11-oxo-, (3β)- [ACD/Index Name]

Potenlini

(2S,3S,4S,5R,6R)-6-(((2S,3R,4S,5S,6S)-6-carboxy-2-(((3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl)oxy)-4,5-dihydroxytetrahydro-2H-pyran-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid

(2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(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]-6-carboxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

(2S,3S,4S,5R,6S)-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]-5-[(2R,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid

(2S,3S,4S,5R,6S)-6-{[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl]oxy}-5-{[(2R,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy}-3,4-dihydroxyoxane-2-carboxylic acid

(3β,20β)-20-Carboxy-11-oxo-30-norlean-12-en-3-yl-2-O-β-1- 7-glucopyranuronosyl-α-D-glucopyranosiduronic acid

(3β,20β)-20-carboxy-11-oxo-30-norolean-12-en-3-yl-2-O-β-D-glucopyranuronosyl-α-D-glucopyranosiduronic acid

[1405-86-3] [RN]

1405-86-3??

18β-Glycyrrhizic acid

18-β-Glycyrrhizic acid

20β-Carboxy-11-oxo-30-norolean-12-en-3β-yl-2-O-β-D-glucopyranuronosyl-α-D-glucopyranosiduronic acid

30-hydroxy-11,30-dioxoolean-12-en-3β-yl (2-O-β-D-glucopyranosyluronic acid)-α-D-glucopyranosiduronic acid

3-O-(2-O-β-D-Glucopyranuronosyl-α-D-glucopyranuronosyl)-18β-glycyrrhetinic acid

4-18-00-05156 [Beilstein]

77922 [Beilstein]

C9MD00345B

CHEMBL441687

EINECS 215-785-7

Glizigen

Glycyram

Glycyron

GLYCYRRHETINIC ACID GLYCOSIDE

glycyrrhizic acid,from licorice

glycyrrhizicacid

Glycyrrhizin (Glycyrrhizic Acid)

Glycyrrhizin (JAN) [JAN]

Glycyrrhizin [JAN]

Glycyrrhizinate

Glycyrrhyzin

Glycyrrizin

glyzyrrhizin

MD2025000

MFCD00167400 [MDL number]

α-D-Glucopyranosiduronic acid, (3β,20β)-20-carboxy-11-oxo-30-norlean-12-en-3-yl-2-O-β-1- 7-glucopyranuronosyl-

α-D-Glucopyranosiduronic acid, (3β,20β)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 2-O-β-D-glucopyranuronosyl-

α-D-Glucopyranosiduronic acid, (3β,20β)-20-carboxy-11-oxo-30-norolean-12-en-3-yl-2-O-β-D-glucopyranuron osyl-

β-Glycyrrhizin

グリチルリチン [Japanese]

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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

6FO62043WK [DBID]

3897076 [DBID]

AIDS000094 [DBID]

AIDS-000094 [DBID]

BRN 0077922 [DBID]

C02284 [DBID]

CHEBI:15939 [DBID]

D00157 [DBID]

GM-1292 [DBID]

HSDB 496 [DBID]

More...

Experimental data
Predicted - ACD/Labs
Predicted - ChemAxon
Predicted - Mcule

Miscellaneous

Safety:

A05BA08 Wikidata Q418705
Target Organs:

Dehydrogenase inhibitor TargetMol T2741

Chemical Class:

Bio Activity:

Dehydrogenase TargetMol T2741

Metabolism TargetMol T2741

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:	1.4±0.1 g/cm³
Boiling Point:	971.4±65.0 °C at 760 mmHg
Vapour Pressure:	0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization:	160.4±6.0 kJ/mol
Flash Point:	288.1±27.8 °C
Index of Refraction:	1.621
Molar Refractivity:	201.4±0.4 cm³
#H bond acceptors:	16
#H bond donors:	8
#Freely Rotating Bonds:	7
#Rule of 5 Violations:	3

ACD/LogP:	4.64
ACD/LogD (pH 5.5):	-1.88
ACD/BCF (pH 5.5):	1.00
ACD/KOC (pH 5.5):	1.00
ACD/LogD (pH 7.4):	-2.26
ACD/BCF (pH 7.4):	1.00
ACD/KOC (pH 7.4):	1.00
Polar Surface Area:	267 Å²
Polarizability:	79.8±0.5 10^-24cm³
Surface Tension:	73.7±5.0 dyne/cm
Molar Volume:	572.6±5.0 cm³

Click to predict properties on the Chemicalize site

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Glycyrrhizin

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Safety:

Target Organs:

Chemical Class:

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