Darutoside

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  • Identifiers

    CAS number
    59219-65-7

    Molecular formula
    C26H44O8

    SMILES
    C[C@@]1(CC[C@@H]2C(=C1)CC[C@H]3[C@]2(CC[C@H](C3(C)C)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)C)[C@H](CO)O

    Safety labels

  • Odor profile

    Fragrance
    Woody 50.8%
    Odorless 39.93%
    Sweet 39.73%
    Amber 31.8%
    Mint 31.64%
    Balsamic 31.47%
    Cooling 30.44%
    Spicy 29.72%
    Dry 29.5%
    Camphoreous 26.66%

     

    Flavor
    Sweet 49.63%
    Bitter 46.51%
    Odorless 31.15%
    Pine 26.56%
    Herbal 26.36%
    Sweet-like 25.9%
    Balsam 25.59%
    Woody 24.8%
    Fatty 24.12%
    Patchouli 21.96%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    1.6

    pKa est.
    5.56 (weak acid)

    Molecular weight
    484.6 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    683°C

    Flash point

    • 270.61 ˚C est.

  • Synonyms

    • Darutoside
    • 59219-65-7
    • EG8ODI0780
    • (2R,3R,4S,5S,6R)-2-[[(2R,4aS,4bR,7S,10aS)-7-[(1R)-1,2-dihydroxyethyl]-1,1,4a,7-tetramethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthren-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
    • (2R,3R,4S,5S,6R)-2-(((2R,4aS,4bR,7S,10aS)-7-((1R)-1,2-dihydroxyethyl)-1,1,4a,7-tetramethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthren-2-yl)oxy)-6-(hydroxymethyl)oxane-3,4,5-triol
    • RefChem:130973
    • (2R,3R,4S,5S,6R)-2-((2R)-2-((2S,4aR,4bS,7R,8aS)-7-hydroxy-2,4b,8,8-tetramethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-yl)-2-hydroxyethoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
    • Darutin
    • (2R,3R,4S,5S,6R)-2-(((2R,4aS,4bR,7S,10aS)-7-((R)-1,2-Dihydroxyethyl)-1,1,4a,7-tetramethyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydrophenanthren-2-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
    • UNII-EG8ODI0780
    • MFCD17214820
    • (2R,3R,4S,5S,6R)-2-[[(2R,4aS,4bR,7S,10aS)-7-[(R)-1,2-Dihydroxyethyl]-1,1,4a,7-tetramethyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydrophenanthren-2-yl]oxy]-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
    • Darutoside (Standard)
    • Darutigenol 3-?-D-glucoside
    • CHEMBL4105670
    • HY-N6028R
    • HY-N6028
    • s9484
    • AKOS037514610
    • MD46041
    • AC-34675
    • DA-62672
    • DARUTIGENOL 3-.BETA.-D-GLUCOSIDE
    • SY232400
    • CS-0032195
    • Q27277170
    • .BETA.-D-GLUCOPYRANOSIDE, 7-((1R)-1,2-DIHYDROXYETHYL)-1,2,3,4,4A,4B,5,6,7,9,10,10A-DODECAHYDRO-1,1,4A,7-TETRAMETHYL-2-PHENANTHRENYL, (2R,4AS,4BR,7S,10AS)-
    • beta-D-Glucopyranoside, 7-(1,2-dihydroxyethyl)-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,1,4a,7-tetramethyl-2-phenanthrenyl
    • 59219-65-7

  • Applications

    Darutoside (CAS 59219-65-7) is a natural triterpene glycoside evaluated for practical applications in cosmetics and personal care as a bioactive skin-conditioning ingredient; it is also studied in pharmaceutical/dermatology contexts and in the development of topical formulations for skin care, and is regarded as a source of plant-derived extracts for cosmetic product lines.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 4.01
    methanol 26.11
    isopropanol 0.72
    water 0.33
    ethyl acetate 1.16
    n-propanol 1.6
    acetone 2.81
    n-butanol 0.78
    acetonitrile 0.67
    DMF 14.57
    toluene 0.57
    isobutanol 0.56
    1,4-dioxane 7.13
    methyl acetate 1.07
    THF 14.15
    2-butanone 1.44
    n-pentanol 0.69
    sec-butanol 0.42
    n-hexane 0.04
    ethylene glycol 4.4
    NMP 20.65
    cyclohexane 0.08
    DMSO 33.69
    n-butyl acetate 0.73
    n-octanol 0.91
    chloroform 1.23
    n-propyl acetate 0.62
    acetic acid 18.63
    dichloromethane 1.2
    cyclohexanone 3.03
    propylene glycol 2.93
    isopropyl acetate 0.96
    DMAc 14.92
    2-ethoxyethanol 9.25
    isopentanol 0.53
    n-heptane 0.08
    ethyl formate 1.37
    1,2-dichloroethane 0.84
    n-hexanol 0.85
    2-methoxyethanol 19.1
    isobutyl acetate 0.44
    tetrachloromethane 0.31
    n-pentyl acetate 1.61
    transcutol 19.26
    n-heptanol 1.41
    ethylbenzene 0.27
    MIBK 0.98
    2-propoxyethanol 10.06
    tert-butanol 0.5
    MTBE 0.44
    2-butoxyethanol 8.11
    propionic acid 2.15
    o-xylene 0.45
    formic acid 30.11
    diethyl ether 0.86
    m-xylene 0.54
    p-xylene 0.26
    chlorobenzene 0.43
    dimethyl carbonate 2.82
    n-octane 0.04
    formamide 22.0
    cyclopentanone 6.25
    2-pentanone 1.38
    anisole 1.01
    cyclopentyl methyl ether 2.86
    gamma-butyrolactone 8.15
    1-methoxy-2-propanol 8.32
    pyridine 3.32
    3-pentanone 1.04
    furfural 9.24
    n-dodecane 0.02
    diethylene glycol 13.39
    diisopropyl ether 0.23
    tert-amyl alcohol 0.41
    acetylacetone 3.93
    n-hexadecane 0.03
    acetophenone 1.56
    methyl propionate 1.78
    isopentyl acetate 0.79
    trichloroethylene 2.16
    n-nonanol 0.99
    cyclohexanol 0.67
    benzyl alcohol 1.75
    2-ethylhexanol 0.45
    isooctanol 0.98
    dipropyl ether 0.78
    1,2-dichlorobenzene 0.46
    ethyl lactate 1.52
    propylene carbonate 2.75
    n-methylformamide 9.26
    2-pentanol 0.35
    n-pentane 0.05
    1-propoxy-2-propanol 4.46
    1-methoxy-2-propyl acetate 3.88
    2-(2-methoxypropoxy) propanol 4.73
    mesitylene 0.33
    ε-caprolactone 3.36
    p-cymene 0.31
    epichlorohydrin 7.41
    1,1,1-trichloroethane 0.38
    2-aminoethanol 6.79
    morpholine-4-carbaldehyde 25.72
    sulfolane 19.12
    2,2,4-trimethylpentane 0.03
    2-methyltetrahydrofuran 2.16
    n-hexyl acetate 1.66
    isooctane 0.03
    2-(2-butoxyethoxy)ethanol 7.96
    sec-butyl acetate 0.43
    tert-butyl acetate 1.24
    decalin 0.05
    glycerin 11.57
    diglyme 14.88
    acrylic acid 4.48
    isopropyl myristate 0.4
    n-butyric acid 2.16
    acetyl acetate 1.67
    di(2-ethylhexyl) phthalate 1.05
    ethyl propionate 0.63
    nitromethane 14.89
    1,2-diethoxyethane 2.21
    benzonitrile 0.72
    trioctyl phosphate 0.69
    1-bromopropane 0.27
    gamma-valerolactone 19.73
    n-decanol 0.52
    triethyl phosphate 0.68
    4-methyl-2-pentanol 0.32
    propionitrile 0.45
    vinylene carbonate 3.34
    1,1,2-trichlorotrifluoroethane 13.68
    DMS 1.75
    cumene 0.21
    2-octanol 0.53
    2-hexanone 0.76
    octyl acetate 0.76
    limonene 0.4
    1,2-dimethoxyethane 6.89
    ethyl orthosilicate 0.69
    tributyl phosphate 0.49
    diacetone alcohol 3.16
    N,N-dimethylaniline 1.04
    acrylonitrile 1.0
    aniline 1.17
    1,3-propanediol 5.45
    bromobenzene 0.33
    dibromomethane 0.66
    1,1,2,2-tetrachloroethane 1.54
    2-methyl-cyclohexyl acetate 0.99
    tetrabutyl urea 0.9
    diisobutyl methanol 0.29
    2-phenylethanol 2.1
    styrene 0.26
    dioctyl adipate 0.95
    dimethyl sulfate 6.74
    ethyl butyrate 0.71
    methyl lactate 4.77
    butyl lactate 2.46
    diethyl carbonate 0.47
    propanediol butyl ether 7.23
    triethyl orthoformate 0.98
    p-tert-butyltoluene 0.35
    methyl 4-tert-butylbenzoate 3.86
    morpholine 8.3
    tert-butylamine 0.19
    n-dodecanol 0.28
    dimethoxymethane 12.52
    ethylene carbonate 2.21
    cyrene 8.93
    2-ethoxyethyl acetate 4.34
    2-ethylhexyl acetate 0.59
    1,2,4-trichlorobenzene 0.76
    4-methylpyridine 1.58
    dibutyl ether 0.4
    2,6-dimethyl-4-heptanol 0.29
    DEF 2.71
    dimethyl isosorbide 9.4
    tetrachloroethylene 1.76
    eugenol 4.5
    triacetin 3.63
    span 80 4.61
    1,4-butanediol 1.98
    1,1-dichloroethane 0.36
    2-methyl-1-pentanol 0.47
    methyl formate 7.4
    2-methyl-1-butanol 0.48
    n-decane 0.06
    butyronitrile 0.37
    3,7-dimethyl-1-octanol 0.56
    1-chlorooctane 0.24
    1-chlorotetradecane 0.07
    n-nonane 0.05
    undecane 0.03
    tert-butylcyclohexane 0.03
    cyclooctane 0.05
    cyclopentanol 1.18
    tetrahydropyran 1.88
    tert-amyl methyl ether 0.45
    2,5,8-trioxanonane 9.49
    1-hexene 0.12
    2-isopropoxyethanol 3.75
    2,2,2-trifluoroethanol 5.82
    methyl butyrate 0.81

    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