(8xi,9xi,16xi,17xi,22R,25R)-26-(beta-D-Glucopyranosyloxy)-22-hydroxy-5beta,14xi-furostan-3beta-yl 3-O-beta-D-glucopyranosyl-beta-D-glucopyranoside

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  • Identifiers

    CAS number
    60267-25-6

    Molecular formula
    C45H76O19

    SMILES
    C[C@H]1C2C(CC3[C@@]2(CCC4C3CC[C@H]5[C@@]4(CC[C@@H](C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)C)C)O[C@@]1(CC[C@@H](C)CO[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O

    Safety labels

  • Odor profile

    Fragrance
    Odorless 60.06%
    Sweet 36.05%
    Cooling 28.69%
    Woody 26.27%
    Mint 25.39%
    Spicy 19.72%
    Balsamic 18.84%
    Warm 18.5%
    Amber 18.44%
    Milky 18.09%

     

    Flavor
    Sweet 48.17%
    Bitter 41.68%
    Odorless 38.74%
    Fatty 37.48%
    Sweet-like 29.25%
    Cauliflower 21.93%
    Metallic 21.81%
    Bland 21.56%
    Mentholic 21.39%
    Alkaline 21.01%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    0.7

    pKa est.
    4.72 (weak acid)

    Molecular weight
    921.1 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    2701°C

    Flash point

    • 265.9 ˚C est.

  • Synonyms

    • DTXSID401317234
    • (8xi,9xi,16xi,17xi,22R,25R)-26-(beta-D-Glucopyranosyloxy)-22-hydroxy-5beta,14xi-furostan-3beta-yl 3-O-beta-D-glucopyranosyl-beta-D-glucopyranoside
    • 60267-25-6
    • 60267-25-6

  • Applications

    Applications of (8xi,9xi,16xi,17xi,22R,25R)-26-(beta-D-Glucopyranosyloxy)-22-hydroxy-5beta,14xi-furostan-3beta-yl 3-O-beta-D-glucopyranosyl-beta-D-glucopyranoside (CAS 60267-25-6) include its use as a natural surfactant and foaming agent in cosmetics and cleaning formulations; as an emulsifier and stabilizer in personal care products; as an intermediate or precursor in the production or modification of steroidal sapogenins (e.g., diosgenin) for pharmaceutical manufacturing; in agrochemical research as a lead scaffold for biopesticide development; and as an excipient or carrier in pharmaceutical formulation development.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1.4
    methanol 14.93
    isopropanol 0.38
    water 0.52
    ethyl acetate 1.5
    n-propanol 0.73
    acetone 3.42
    n-butanol 0.36
    acetonitrile 1.2
    DMF 26.66
    toluene 0.37
    isobutanol 0.27
    1,4-dioxane 6.27
    methyl acetate 1.62
    THF 11.01
    2-butanone 1.58
    n-pentanol 0.36
    sec-butanol 0.23
    n-hexane 0.01
    ethylene glycol 4.31
    NMP 31.45
    cyclohexane 0.03
    DMSO 51.89
    n-butyl acetate 0.72
    n-octanol 0.66
    chloroform 2.04
    n-propyl acetate 0.83
    acetic acid 24.46
    dichloromethane 2.28
    cyclohexanone 3.17
    propylene glycol 2.11
    isopropyl acetate 1.01
    DMAc 23.2
    2-ethoxyethanol 6.3
    isopentanol 0.23
    n-heptane 0.04
    ethyl formate 1.98
    1,2-dichloroethane 1.13
    n-hexanol 0.34
    2-methoxyethanol 13.67
    isobutyl acetate 0.44
    tetrachloromethane 0.34
    n-pentyl acetate 1.74
    transcutol 13.18
    n-heptanol 0.78
    ethylbenzene 0.15
    MIBK 0.79
    2-propoxyethanol 5.84
    tert-butanol 0.27
    MTBE 0.26
    2-butoxyethanol 5.61
    propionic acid 2.25
    o-xylene 0.28
    formic acid 45.29
    diethyl ether 0.54
    m-xylene 0.3
    p-xylene 0.2
    chlorobenzene 0.51
    dimethyl carbonate 5.18
    n-octane 0.02
    formamide 30.2
    cyclopentanone 7.42
    2-pentanone 1.34
    anisole 0.84
    cyclopentyl methyl ether 1.81
    gamma-butyrolactone 12.27
    1-methoxy-2-propanol 6.0
    pyridine 3.58
    3-pentanone 1.1
    furfural 17.37
    n-dodecane 0.02
    diethylene glycol 9.82
    diisopropyl ether 0.13
    tert-amyl alcohol 0.23
    acetylacetone 6.15
    n-hexadecane 0.02
    acetophenone 1.72
    methyl propionate 2.31
    isopentyl acetate 0.61
    trichloroethylene 3.7
    n-nonanol 0.69
    cyclohexanol 0.36
    benzyl alcohol 1.25
    2-ethylhexanol 0.21
    isooctanol 0.48
    dipropyl ether 0.52
    1,2-dichlorobenzene 0.61
    ethyl lactate 1.77
    propylene carbonate 4.46
    n-methylformamide 12.6
    2-pentanol 0.17
    n-pentane 0.02
    1-propoxy-2-propanol 2.95
    1-methoxy-2-propyl acetate 3.28
    2-(2-methoxypropoxy) propanol 3.74
    mesitylene 0.17
    ε-caprolactone 3.66
    p-cymene 0.19
    epichlorohydrin 9.28
    1,1,1-trichloroethane 0.56
    2-aminoethanol 3.78
    morpholine-4-carbaldehyde 33.06
    sulfolane 34.99
    2,2,4-trimethylpentane 0.01
    2-methyltetrahydrofuran 1.6
    n-hexyl acetate 1.63
    isooctane 0.01
    2-(2-butoxyethoxy)ethanol 6.21
    sec-butyl acetate 0.45
    tert-butyl acetate 1.03
    decalin 0.02
    glycerin 10.95
    diglyme 12.75
    acrylic acid 6.13
    isopropyl myristate 0.41
    n-butyric acid 2.1
    acetyl acetate 2.97
    di(2-ethylhexyl) phthalate 0.99
    ethyl propionate 0.83
    nitromethane 34.64
    1,2-diethoxyethane 1.87
    benzonitrile 1.06
    trioctyl phosphate 0.66
    1-bromopropane 0.24
    gamma-valerolactone 27.45
    n-decanol 0.39
    triethyl phosphate 0.69
    4-methyl-2-pentanol 0.14
    propionitrile 0.53
    vinylene carbonate 6.24
    1,1,2-trichlorotrifluoroethane 20.52
    DMS 2.18
    cumene 0.12
    2-octanol 0.36
    2-hexanone 0.76
    octyl acetate 0.84
    limonene 0.22
    1,2-dimethoxyethane 6.38
    ethyl orthosilicate 0.58
    tributyl phosphate 0.52
    diacetone alcohol 2.63
    N,N-dimethylaniline 0.74
    acrylonitrile 1.6
    aniline 0.81
    1,3-propanediol 3.01
    bromobenzene 0.43
    dibromomethane 0.86
    1,1,2,2-tetrachloroethane 2.33
    2-methyl-cyclohexyl acetate 0.78
    tetrabutyl urea 1.01
    diisobutyl methanol 0.14
    2-phenylethanol 1.24
    styrene 0.2
    dioctyl adipate 1.12
    dimethyl sulfate 13.95
    ethyl butyrate 0.75
    methyl lactate 6.02
    butyl lactate 2.41
    diethyl carbonate 0.54
    propanediol butyl ether 5.65
    triethyl orthoformate 0.9
    p-tert-butyltoluene 0.18
    methyl 4-tert-butylbenzoate 3.42
    morpholine 5.93
    tert-butylamine 0.08
    n-dodecanol 0.23
    dimethoxymethane 12.76
    ethylene carbonate 3.43
    cyrene 8.9
    2-ethoxyethyl acetate 4.94
    2-ethylhexyl acetate 0.49
    1,2,4-trichlorobenzene 0.96
    4-methylpyridine 1.76
    dibutyl ether 0.34
    2,6-dimethyl-4-heptanol 0.14
    DEF 3.24
    dimethyl isosorbide 8.31
    tetrachloroethylene 2.17
    eugenol 3.79
    triacetin 4.69
    span 80 3.91
    1,4-butanediol 1.48
    1,1-dichloroethane 0.52
    2-methyl-1-pentanol 0.21
    methyl formate 12.94
    2-methyl-1-butanol 0.22
    n-decane 0.04
    butyronitrile 0.39
    3,7-dimethyl-1-octanol 0.31
    1-chlorooctane 0.19
    1-chlorotetradecane 0.06
    n-nonane 0.03
    undecane 0.03
    tert-butylcyclohexane 0.01
    cyclooctane 0.02
    cyclopentanol 0.74
    tetrahydropyran 1.26
    tert-amyl methyl ether 0.29
    2,5,8-trioxanonane 8.24
    1-hexene 0.05
    2-isopropoxyethanol 2.56
    2,2,2-trifluoroethanol 12.12
    methyl butyrate 1.05

    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