I(2)-D-Galactopyranoside, (3I(2),5I+/-,25S)-spirostan-3-yl O-I(2)-D-glucopyranosyl-(1a2)-O-[I(2)-D-glucopyranosyl-(1a3)]-O-6-O-acetyl-I(2)-D-glucopyranosyl-(1a4)-

  • Identifiers

    Molecular formula
    C53H86O24

    SMILES
    C[C@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@@H]6[C@@]5(CC[C@@H](C6)O[C@H]7[C@@H]([C@H]([C@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)COC(=O)C)O)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)C)C)C)OC1

    Safety labels

  • Odor profile

    Fragrance
    Odorless 63.93%
    Sweet 30.18%
    Cooling 24.45%
    Woody 23.25%
    Mint 21.0%
    Spicy 19.24%
    Vanilla 18.12%
    Milky 17.83%
    Warm 17.14%
    Clean 16.48%

     

    Flavor
    Bitter 46.21%
    Sweet 44.79%
    Fatty 41.75%
    Odorless 34.92%
    Sweet-like 29.17%
    Metallic 23.8%
    Cauliflower 22.26%
    Bland 21.89%
    Alkaline 21.48%
    Mentholic 21.22%

     

    Odor impact est.
    Odorless

  • Properties

    XLogP3-AA
    -0.4

    pKa est.
    2.05 (strong acid)

    Molecular weight
    1107.2 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    2779°C

    Flash point

    • 148.73 ˚C est.

  • Synonyms

    • 226713-77-5
  • Applications

    Applications of I(2)-D-Galactopyranoside, (3I(2),5I+/-,25S)-spirostan-3-yl O-I(2)-D-glucopyranosyl-(1a2)-O-[I(2)-D-glucopyranosyl-(1a3)]-O-6-O-acetyl-I(2)-D-glucopyranosyl-(1a4)- include use as a nonionic surfactant and emulsifier in cosmetics and personal care formulations; as a surfactant/foaming agent in household cleaners and industrial cleaners; as an intermediate or building block for synthesizing steroidal glycoside derivatives used in pharmaceutical R&D; as an additive in coatings, inks, and polymer formulations to improve wetting, dispersion, and stability; and potentially as an agricultural adjuvant or surfactant in agrochemical formulations, subject to regulatory limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 0.86
    methanol 9.05
    isopropanol 0.24
    water 0.29
    ethyl acetate 0.84
    n-propanol 0.41
    acetone 2.37
    n-butanol 0.2
    acetonitrile 0.92
    DMF 24.06
    toluene 0.21
    isobutanol 0.16
    1,4-dioxane 4.03
    methyl acetate 1.15
    THF 5.78
    2-butanone 1.0
    n-pentanol 0.21
    sec-butanol 0.14
    n-hexane 0.01
    ethylene glycol 3.0
    NMP 24.66
    cyclohexane 0.02
    DMSO 38.8
    n-butyl acetate 0.46
    n-octanol 0.4
    chloroform 1.32
    n-propyl acetate 0.55
    acetic acid 16.61
    dichloromethane 1.63
    cyclohexanone 1.76
    propylene glycol 1.52
    isopropyl acetate 0.55
    DMAc 19.57
    2-ethoxyethanol 4.47
    isopentanol 0.13
    n-heptane 0.02
    ethyl formate 1.43
    1,2-dichloroethane 0.73
    n-hexanol 0.18
    2-methoxyethanol 9.47
    isobutyl acetate 0.31
    tetrachloromethane 0.17
    n-pentyl acetate 1.08
    transcutol 9.88
    n-heptanol 0.44
    ethylbenzene 0.09
    MIBK 0.45
    2-propoxyethanol 3.86
    tert-butanol 0.16
    MTBE 0.14
    2-butoxyethanol 3.71
    propionic acid 1.41
    o-xylene 0.16
    formic acid 34.3
    diethyl ether 0.28
    m-xylene 0.16
    p-xylene 0.13
    chlorobenzene 0.31
    dimethyl carbonate 3.66
    n-octane 0.01
    formamide 23.52
    cyclopentanone 4.3
    2-pentanone 0.73
    anisole 0.55
    cyclopentyl methyl ether 0.87
    gamma-butyrolactone 7.9
    1-methoxy-2-propanol 3.98
    pyridine 2.44
    3-pentanone 0.62
    furfural 13.6
    n-dodecane 0.01
    diethylene glycol 7.23
    diisopropyl ether 0.06
    tert-amyl alcohol 0.14
    acetylacetone 4.03
    n-hexadecane 0.01
    acetophenone 1.2
    methyl propionate 1.45
    isopentyl acetate 0.37
    trichloroethylene 2.61
    n-nonanol 0.42
    cyclohexanol 0.18
    benzyl alcohol 0.84
    2-ethylhexanol 0.11
    isooctanol 0.27
    dipropyl ether 0.31
    1,2-dichlorobenzene 0.39
    ethyl lactate 1.35
    propylene carbonate 2.82
    n-methylformamide 10.36
    2-pentanol 0.09
    n-pentane 0.01
    1-propoxy-2-propanol 1.9
    1-methoxy-2-propyl acetate 2.12
    2-(2-methoxypropoxy) propanol 2.85
    mesitylene 0.09
    ε-caprolactone 2.12
    p-cymene 0.1
    epichlorohydrin 5.81
    1,1,1-trichloroethane 0.34
    2-aminoethanol 2.45
    morpholine-4-carbaldehyde 25.36
    sulfolane 23.51
    2,2,4-trimethylpentane 0.0
    2-methyltetrahydrofuran 0.84
    n-hexyl acetate 1.05
    isooctane 0.0
    2-(2-butoxyethoxy)ethanol 4.63
    sec-butyl acetate 0.28
    tert-butyl acetate 0.58
    decalin 0.01
    glycerin 8.33
    diglyme 9.58
    acrylic acid 4.41
    isopropyl myristate 0.25
    n-butyric acid 1.2
    acetyl acetate 1.76
    di(2-ethylhexyl) phthalate 0.7
    ethyl propionate 0.51
    nitromethane 29.2
    1,2-diethoxyethane 1.3
    benzonitrile 0.77
    trioctyl phosphate 0.43
    1-bromopropane 0.13
    gamma-valerolactone 18.52
    n-decanol 0.24
    triethyl phosphate 0.44
    4-methyl-2-pentanol 0.07
    propionitrile 0.36
    vinylene carbonate 4.02
    1,1,2-trichlorotrifluoroethane 16.08
    DMS 1.54
    cumene 0.06
    2-octanol 0.21
    2-hexanone 0.49
    octyl acetate 0.54
    limonene 0.12
    1,2-dimethoxyethane 5.09
    ethyl orthosilicate 0.36
    tributyl phosphate 0.34
    diacetone alcohol 1.67
    N,N-dimethylaniline 0.49
    acrylonitrile 1.22
    aniline 0.49
    1,3-propanediol 1.88
    bromobenzene 0.27
    dibromomethane 0.52
    1,1,2,2-tetrachloroethane 1.58
    2-methyl-cyclohexyl acetate 0.47
    tetrabutyl urea 0.73
    diisobutyl methanol 0.07
    2-phenylethanol 0.75
    styrene 0.11
    dioctyl adipate 0.76
    dimethyl sulfate 11.2
    ethyl butyrate 0.46
    methyl lactate 4.22
    butyl lactate 1.69
    diethyl carbonate 0.36
    propanediol butyl ether 4.23
    triethyl orthoformate 0.59
    p-tert-butyltoluene 0.09
    methyl 4-tert-butylbenzoate 2.42
    morpholine 3.63
    tert-butylamine 0.04
    n-dodecanol 0.14
    dimethoxymethane 9.19
    ethylene carbonate 2.08
    cyrene 6.74
    2-ethoxyethyl acetate 3.38
    2-ethylhexyl acetate 0.3
    1,2,4-trichlorobenzene 0.66
    4-methylpyridine 1.22
    dibutyl ether 0.23
    2,6-dimethyl-4-heptanol 0.07
    DEF 2.07
    dimethyl isosorbide 6.15
    tetrachloroethylene 1.33
    eugenol 2.84
    triacetin 3.55
    span 80 2.89
    1,4-butanediol 0.99
    1,1-dichloroethane 0.33
    2-methyl-1-pentanol 0.12
    methyl formate 10.84
    2-methyl-1-butanol 0.12
    n-decane 0.02
    butyronitrile 0.24
    3,7-dimethyl-1-octanol 0.19
    1-chlorooctane 0.11
    1-chlorotetradecane 0.04
    n-nonane 0.02
    undecane 0.02
    tert-butylcyclohexane 0.01
    cyclooctane 0.01
    cyclopentanol 0.38
    tetrahydropyran 0.66
    tert-amyl methyl ether 0.16
    2,5,8-trioxanonane 6.34
    1-hexene 0.03
    2-isopropoxyethanol 1.79
    2,2,2-trifluoroethanol 8.48
    methyl butyrate 0.7

    Scent© AI

1 of 4
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