alpha-D-Glucopyranosiduronic acid, (3beta,20beta)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 2-O-beta-D-glucopyranuronosyl-, potassium salt (1:?)

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  • Identifiers

    CAS number
    68039-19-0

    Molecular formula
    C42H61KO16

    SMILES
    C[C@]12CC[C@](C[C@H]1C3=CC(=O)[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)[O-])O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)C(=O)O)O)O)O)C)(C)C(=O)O.[K+]

    Safety labels

  • Odor profile

    Fragrance
    Odorless 53.63%
    Spicy 37.66%
    Woody 37.3%
    Dry 25.78%
    Cooling 25.68%
    Amber 24.0%
    Balsamic 23.71%
    Cedar 21.75%
    Warm 20.77%
    Mint 20.36%

     

    Flavor
    Bitter 73.0%
    Odorless 29.59%
    Bland 26.15%
    Sweet-like 24.28%
    Cedarleaf 22.46%
    Ripe apricot 20.86%
    Red fruit 20.46%
    Parsley 20.22%
    Patchouli 20.04%
    Leaves 19.95%

     

    Odor impact est.
    Odorless

  • Properties

    pKa est.
    0.73 (strong acid)

    Molecular weight
    861.0 g/mol

    Flash point

    • 261.03 ˚C est.

  • Synonyms

    • Potassium Glycyrrhizinate
    • alpha-D-Glucopyranosiduronic acid, (3beta,20beta)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 2-O-beta-D-glucopyranuronosyl-, potassium salt (1:?)
    • RefChem:555619
    • .alpha.-D-Glucopyranosiduronic acid, (3.beta.,20.beta.)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 2-O-.beta.-D-glucopyranuronosyl-, potassium salt (1:?)
    • Glycyrrhizinic acid, potassium salt
    • 68039-19-0
    • 42294-03-1
    • alpha-D-Glucopyranosiduronic acid, (3beta,20beta)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 2-O-beta-D-glucopyranuronosyl-, potassium salt
    • potassium;(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-carboxylate
    • T8XVV1JDN8
    • Monopotassium glycyrrhizinate
    • Monopotassium glycyrrhizin
    • EINECS 268-237-4
    • UNII-T8XVV1JDN8
    • orb1299470
    • SCHEMBL2581882
    • EINECS 255-754-5
    • .alpha.-D-Glucopyranosiduronic acid, (3.beta.,20.beta.)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 2-O-.beta.-D-glucopyranuronosyl-, potassium salt
    • alpha-D-Glucopyranosiduronic acid, (3beta,20beta)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 2-O-beta-D-glucopyranuronosyl-, potassiumsalt
    • 68039-19-0

  • Applications

    alpha-D-Glucopyranosiduronic acid, (3beta,20beta)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 2-O-beta-D-glucopyranuronosyl-, potassium salt (1:?) CAS 68039-19-0 is a norolean-type triterpenoid glycoside salt, and in practical applications it is commonly evaluated as an intermediate for the synthesis of triterpenoid glycosides and may be used as a biobased surfactant or emulsifier in cosmetics and household cleaning formulations; it can serve as a starting material for pharmaceutical research and development and as an ingredient or adjuvant in agricultural formulation systems to improve formulation stability and delivery.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 3.65
    methanol 24.84
    isopropanol 1.27
    water 0.08
    ethyl acetate 2.68
    n-propanol 1.96
    acetone 10.34
    n-butanol 0.69
    acetonitrile 2.53
    DMF 96.03
    toluene 0.87
    isobutanol 0.7
    1,4-dioxane 13.97
    methyl acetate 4.5
    THF 28.94
    2-butanone 4.06
    n-pentanol 0.67
    sec-butanol 0.6
    n-hexane 0.03
    ethylene glycol 8.3
    NMP 64.6
    cyclohexane 0.06
    DMSO 80.48
    n-butyl acetate 0.88
    n-octanol 0.54
    chloroform 4.43
    n-propyl acetate 1.32
    acetic acid 38.74
    dichloromethane 4.57
    cyclohexanone 4.11
    propylene glycol 7.06
    isopropyl acetate 1.5
    DMAc 57.39
    2-ethoxyethanol 10.89
    isopentanol 0.37
    n-heptane 0.04
    ethyl formate 2.83
    1,2-dichloroethane 2.44
    n-hexanol 0.48
    2-methoxyethanol 27.61
    isobutyl acetate 0.59
    tetrachloromethane 0.49
    n-pentyl acetate 1.35
    transcutol 16.0
    n-heptanol 0.61
    ethylbenzene 0.28
    MIBK 1.22
    2-propoxyethanol 10.97
    tert-butanol 0.86
    MTBE 0.69
    2-butoxyethanol 5.06
    propionic acid 4.31
    o-xylene 0.52
    formic acid 41.66
    diethyl ether 1.26
    m-xylene 0.54
    p-xylene 0.38
    chlorobenzene 0.79
    dimethyl carbonate 10.44
    n-octane 0.03
    formamide 35.59
    cyclopentanone 15.36
    2-pentanone 2.37
    anisole 1.62
    cyclopentyl methyl ether 3.24
    gamma-butyrolactone 24.57
    1-methoxy-2-propanol 14.97
    pyridine 7.54
    3-pentanone 2.18
    furfural 20.07
    n-dodecane 0.02
    diethylene glycol 17.95
    diisopropyl ether 0.22
    tert-amyl alcohol 0.54
    acetylacetone 10.31
    n-hexadecane 0.02
    acetophenone 2.48
    methyl propionate 5.34
    isopentyl acetate 0.61
    trichloroethylene 8.35
    n-nonanol 0.55
    cyclohexanol 0.53
    benzyl alcohol 2.06
    2-ethylhexanol 0.19
    isooctanol 0.38
    dipropyl ether 0.79
    1,2-dichlorobenzene 0.84
    ethyl lactate 2.38
    propylene carbonate 5.77
    n-methylformamide 31.71
    2-pentanol 0.33
    n-pentane 0.03
    1-propoxy-2-propanol 4.9
    1-methoxy-2-propyl acetate 4.39
    2-(2-methoxypropoxy) propanol 3.86
    mesitylene 0.28
    ε-caprolactone 4.45
    p-cymene 0.17
    epichlorohydrin 18.71
    1,1,1-trichloroethane 1.32
    2-aminoethanol 7.4
    morpholine-4-carbaldehyde 57.14
    sulfolane 49.01
    2,2,4-trimethylpentane 0.01
    2-methyltetrahydrofuran 3.68
    n-hexyl acetate 1.42
    isooctane 0.01
    2-(2-butoxyethoxy)ethanol 6.18
    sec-butyl acetate 0.6
    tert-butyl acetate 1.73
    decalin 0.03
    glycerin 20.48
    diglyme 13.73
    acrylic acid 10.65
    isopropyl myristate 0.33
    n-butyric acid 2.53
    acetyl acetate 3.9
    di(2-ethylhexyl) phthalate 0.74
    ethyl propionate 1.36
    nitromethane 63.31
    1,2-diethoxyethane 2.51
    benzonitrile 1.25
    trioctyl phosphate 0.46
    1-bromopropane 0.5
    gamma-valerolactone 36.42
    n-decanol 0.32
    triethyl phosphate 0.56
    4-methyl-2-pentanol 0.2
    propionitrile 1.28
    vinylene carbonate 6.96
    1,1,2-trichlorotrifluoroethane 30.4
    DMS 3.22
    cumene 0.16
    2-octanol 0.31
    2-hexanone 1.21
    octyl acetate 0.69
    limonene 0.2
    1,2-dimethoxyethane 12.42
    ethyl orthosilicate 0.5
    tributyl phosphate 0.4
    diacetone alcohol 4.49
    N,N-dimethylaniline 1.46
    acrylonitrile 3.83
    aniline 1.5
    1,3-propanediol 5.27
    bromobenzene 0.72
    dibromomethane 1.66
    1,1,2,2-tetrachloroethane 5.67
    2-methyl-cyclohexyl acetate 0.7
    tetrabutyl urea 0.94
    diisobutyl methanol 0.14
    2-phenylethanol 1.54
    styrene 0.36
    dioctyl adipate 0.89
    dimethyl sulfate 24.81
    ethyl butyrate 0.82
    methyl lactate 10.06
    butyl lactate 1.98
    diethyl carbonate 0.55
    propanediol butyl ether 6.56
    triethyl orthoformate 0.91
    p-tert-butyltoluene 0.2
    methyl 4-tert-butylbenzoate 3.21
    morpholine 14.21
    tert-butylamine 0.22
    n-dodecanol 0.19
    dimethoxymethane 38.97
    ethylene carbonate 3.79
    cyrene 11.31
    2-ethoxyethyl acetate 4.33
    2-ethylhexyl acetate 0.42
    1,2,4-trichlorobenzene 1.46
    4-methylpyridine 3.42
    dibutyl ether 0.36
    2,6-dimethyl-4-heptanol 0.14
    DEF 5.15
    dimethyl isosorbide 9.3
    tetrachloroethylene 4.04
    eugenol 3.43
    triacetin 4.19
    span 80 3.94
    1,4-butanediol 2.41
    1,1-dichloroethane 1.34
    2-methyl-1-pentanol 0.32
    methyl formate 30.62
    2-methyl-1-butanol 0.38
    n-decane 0.04
    butyronitrile 0.63
    3,7-dimethyl-1-octanol 0.27
    1-chlorooctane 0.17
    1-chlorotetradecane 0.05
    n-nonane 0.03
    undecane 0.02
    tert-butylcyclohexane 0.02
    cyclooctane 0.03
    cyclopentanol 1.63
    tetrahydropyran 2.75
    tert-amyl methyl ether 0.6
    2,5,8-trioxanonane 8.06
    1-hexene 0.12
    2-isopropoxyethanol 4.21
    2,2,2-trifluoroethanol 12.14
    methyl butyrate 1.68

    Scent© AI

1 4

IFRA standard 51

Recommendation
No restriction
Maximum acceptable concentrations in the finished product (%)
Category 1
Products applied to the lips
 No restriction Category 7A
Rinse-off products applied to the hair with some hand contact
 No restriction
Category 2
Products applied to the axillae
 No restriction Category 7B
Leave-on products applied to the hair with some hand contact
 No restriction
Category 3
Products applied to the face/body using fingertips
 No restriction Category 8
Products with significant anogenital exposure
 No restriction
Category 4
Products related to fine fragrance
 No restriction Category 9
Products with body and hand exposure, primarily rinse off
 No restriction
Category 5A
Body lotion products applied to the body using the hands (palms), primarily leave on
 No restriction Category 10A
Household care products with mostly hand contact
 No restriction
Category 5B
Face moisturizer products applied to the face using the hands (palms), primarily leave on
 No restriction Category 10B
Household care products with mostly hand contact, including aerosol/spray products (with potential leave-on skin contact)
 No restriction
Category 5C
Hand cream products applied to the hands using the hands (palms), primarily leave on
 No restriction Category 11A
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
 No restriction
Category 5D
Baby Creams, baby Oils and baby talc
 No restriction Category 11B
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
 No restriction
Category 6
Products with oral and lip exposure
 No restriction Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
 No restriction