Phaseoluside A

Overview IFRA Request a quote

  • Identifiers

    CAS number
    137231-80-2

    Molecular formula
    C48H80O18

    SMILES
    CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(C(C1)O)C)C)C)(C)CO)OC6C(C(C(C(O6)CO)OC7C(C(C(C(O7)CO)O)O)O)OC8C(C(C(C(O8)CO)O)O)O)O)C)C

    Safety labels

  • Odor profile

    Fragrance
    Odorless 52.67%
    Woody 41.41%
    Sweet 33.2%
    Spicy 28.41%
    Cooling 27.26%
    Amber 25.97%
    Balsamic 25.53%
    Mint 25.47%
    Dry 24.19%
    Warm 22.18%

     

    Flavor
    Bitter 49.08%
    Sweet 45.79%
    Odorless 33.22%
    Fatty 30.93%
    Sweet-like 27.72%
    Patchouli 21.7%
    Cedarleaf 21.44%
    Mentholic 21.43%
    Old paper 21.32%
    Soil 21.21%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    1.1

    pKa est.
    3.62 (weak acid)

    Molecular weight
    945.1 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    2946°C

    Melting point expt.

    • 245 - 248 °C

    Flash point

    • 263.83 ˚C est.

  • Synonyms

    • Phaseoluside A
    • SCHEMBL29934820
    • CHEBI:231024
    • DTXSID301104876
    • 137231-80-2
    • 2-[5-hydroxy-6-[[9-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-2-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
    • I(2)-D-Glucopyranoside, (3I(2),4I(2),22I(2))-22,23-dihydroxyolean-12-en-3-yl O-I(2)-D-glucopyranosyl-(1a3)-O-[I(2)-D-glucopyranosyl-(1a4)]-
    • 137231-80-2

  • Applications

    Phaseoluside A is a natural product isolated from Phaseolus plant sources and is currently under research/industrial evaluation. It may be considered as an organic synthesis intermediate and has potential to serve as a surface-active agent or emulsifier in cleaning and household formulations. With its relatively stable characteristics and interactive structure, it could be explored as a fragrance component in perfumery or flavor-related applications in experimental formulations. In cosmetics and personal care, Phaseoluside A could be evaluated as a supporting additive or stabilizer/emulsifier within permitted formulations. Additionally, it may be examined as a specialty additive or processing aid in polymer or coating formulations to improve processability or surface properties, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 0.68
    methanol 7.84
    isopropanol 0.16
    water 0.06
    ethyl acetate 0.27
    n-propanol 0.3
    acetone 0.96
    n-butanol 0.12
    acetonitrile 0.31
    DMF 11.29
    toluene 0.1
    isobutanol 0.11
    1,4-dioxane 1.9
    methyl acetate 0.44
    THF 2.72
    2-butanone 0.47
    n-pentanol 0.12
    sec-butanol 0.09
    n-hexane 0.01
    ethylene glycol 1.55
    NMP 9.17
    cyclohexane 0.01
    DMSO 12.45
    n-butyl acetate 0.19
    n-octanol 0.22
    chloroform 0.49
    n-propyl acetate 0.21
    acetic acid 4.59
    dichloromethane 0.52
    cyclohexanone 0.62
    propylene glycol 1.02
    isopropyl acetate 0.18
    DMAc 7.71
    2-ethoxyethanol 2.23
    isopentanol 0.07
    n-heptane 0.01
    ethyl formate 0.48
    1,2-dichloroethane 0.26
    n-hexanol 0.1
    2-methoxyethanol 4.73
    isobutyl acetate 0.12
    tetrachloromethane 0.07
    n-pentyl acetate 0.5
    transcutol 5.24
    n-heptanol 0.25
    ethylbenzene 0.05
    MIBK 0.19
    2-propoxyethanol 2.19
    tert-butanol 0.1
    MTBE 0.09
    2-butoxyethanol 2.12
    propionic acid 0.59
    o-xylene 0.08
    formic acid 10.95
    diethyl ether 0.16
    m-xylene 0.08
    p-xylene 0.06
    chlorobenzene 0.11
    dimethyl carbonate 1.13
    n-octane 0.01
    formamide 7.33
    cyclopentanone 1.53
    2-pentanone 0.31
    anisole 0.29
    cyclopentyl methyl ether 0.37
    gamma-butyrolactone 2.25
    1-methoxy-2-propanol 2.08
    pyridine 1.0
    3-pentanone 0.28
    furfural 4.1
    n-dodecane 0.01
    diethylene glycol 3.68
    diisopropyl ether 0.03
    tert-amyl alcohol 0.09
    acetylacetone 1.19
    n-hexadecane 0.01
    acetophenone 0.49
    methyl propionate 0.53
    isopentyl acetate 0.16
    trichloroethylene 0.85
    n-nonanol 0.23
    cyclohexanol 0.09
    benzyl alcohol 0.41
    2-ethylhexanol 0.06
    isooctanol 0.16
    dipropyl ether 0.18
    1,2-dichlorobenzene 0.13
    ethyl lactate 0.52
    propylene carbonate 0.72
    n-methylformamide 4.51
    2-pentanol 0.05
    n-pentane 0.01
    1-propoxy-2-propanol 1.12
    1-methoxy-2-propyl acetate 0.95
    2-(2-methoxypropoxy) propanol 1.65
    mesitylene 0.05
    ε-caprolactone 0.67
    p-cymene 0.05
    epichlorohydrin 1.97
    1,1,1-trichloroethane 0.11
    2-aminoethanol 1.54
    morpholine-4-carbaldehyde 10.31
    sulfolane 6.63
    2,2,4-trimethylpentane 0.0
    2-methyltetrahydrofuran 0.37
    n-hexyl acetate 0.46
    isooctane 0.0
    2-(2-butoxyethoxy)ethanol 2.44
    sec-butyl acetate 0.1
    tert-butyl acetate 0.23
    decalin 0.01
    glycerin 4.05
    diglyme 5.05
    acrylic acid 1.49
    isopropyl myristate 0.11
    n-butyric acid 0.38
    acetyl acetate 0.43
    di(2-ethylhexyl) phthalate 0.31
    ethyl propionate 0.18
    nitromethane 7.18
    1,2-diethoxyethane 0.65
    benzonitrile 0.26
    trioctyl phosphate 0.19
    1-bromopropane 0.05
    gamma-valerolactone 6.57
    n-decanol 0.12
    triethyl phosphate 0.17
    4-methyl-2-pentanol 0.04
    propionitrile 0.16
    vinylene carbonate 1.06
    1,1,2-trichlorotrifluoroethane 6.2
    DMS 0.59
    cumene 0.04
    2-octanol 0.12
    2-hexanone 0.23
    octyl acetate 0.22
    limonene 0.06
    1,2-dimethoxyethane 2.62
    ethyl orthosilicate 0.16
    tributyl phosphate 0.13
    diacetone alcohol 0.72
    N,N-dimethylaniline 0.28
    acrylonitrile 0.46
    aniline 0.21
    1,3-propanediol 0.91
    bromobenzene 0.09
    dibromomethane 0.19
    1,1,2,2-tetrachloroethane 0.56
    2-methyl-cyclohexyl acetate 0.21
    tetrabutyl urea 0.32
    diisobutyl methanol 0.04
    2-phenylethanol 0.39
    styrene 0.06
    dioctyl adipate 0.3
    dimethyl sulfate 3.07
    ethyl butyrate 0.18
    methyl lactate 1.57
    butyl lactate 0.8
    diethyl carbonate 0.13
    propanediol butyl ether 2.55
    triethyl orthoformate 0.25
    p-tert-butyltoluene 0.05
    methyl 4-tert-butylbenzoate 1.16
    morpholine 1.81
    tert-butylamine 0.03
    n-dodecanol 0.07
    dimethoxymethane 4.41
    ethylene carbonate 0.56
    cyrene 3.48
    2-ethoxyethyl acetate 1.53
    2-ethylhexyl acetate 0.13
    1,2,4-trichlorobenzene 0.21
    4-methylpyridine 0.44
    dibutyl ether 0.11
    2,6-dimethyl-4-heptanol 0.04
    DEF 0.8
    dimethyl isosorbide 3.05
    tetrachloroethylene 0.52
    eugenol 1.42
    triacetin 1.34
    span 80 1.48
    1,4-butanediol 0.5
    1,1-dichloroethane 0.11
    2-methyl-1-pentanol 0.07
    methyl formate 4.05
    2-methyl-1-butanol 0.08
    n-decane 0.01
    butyronitrile 0.1
    3,7-dimethyl-1-octanol 0.1
    1-chlorooctane 0.05
    1-chlorotetradecane 0.02
    n-nonane 0.01
    undecane 0.01
    tert-butylcyclohexane 0.0
    cyclooctane 0.01
    cyclopentanol 0.18
    tetrahydropyran 0.31
    tert-amyl methyl ether 0.09
    2,5,8-trioxanonane 3.21
    1-hexene 0.02
    2-isopropoxyethanol 0.93
    2,2,2-trifluoroethanol 2.12
    methyl butyrate 0.25

    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