Eriojaposide A

  • Identifiers

    CAS number
    290308-51-9

    Molecular formula
    C24H38O11

    SMILES
    CC1=CC(=O)CC([C@H]1/C=C/[C@@H](C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO[C@H]3[C@@H]([C@H]([C@@H](CO3)O)O)O)O)O)O)(C)C

    Safety labels

  • Odor profile

    Fragrance
    Odorless 53.79%
    Sweet 30.6%
    Woody 28.29%
    Spicy 26.77%
    Milky 20.24%
    Mint 19.45%
    Vanilla 19.32%
    Cooling 18.74%
    Warm 18.33%
    Creamy 16.83%

     

    Flavor
    Bitter 70.52%
    Sweet-like 24.29%
    Fatty 24.06%
    Odorless 23.93%
    Bland 22.94%
    Cedarleaf 21.68%
    Leaves 19.66%
    Parsley 19.56%
    Lovage 19.43%
    Ripe apricot 19.41%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    -2.0

    pKa est.
    5.9 (weak acid)

    Molecular weight
    502.6 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    2948°C

    Flash point

    • 211.32 ˚C est.

  • Synonyms

    • Eriojaposide A
    • DTXSID701317219
    • 290308-51-9
    • RefChem:137640
    • (6R,9R)-3-oxo-alpha-ionyl-9-O-beta-xylopyranosyl-(1''-6')-beta-glucopyranoside
    • DTXCID901747040
    • 3,5,5-trimethyl-4-((1E)-3-((3,4,5-trihydroxy-6-(((3,4,5-trihydroxyoxan-2-yl)oxy)methyl)oxan-2-yl)oxy)but-1-en-1-yl)cyclohex-2-en-1-one
    • 3,5,5-trimethyl-4-((E)-3-(3,4,5-trihydroxy-6-((3,4,5-trihydroxyoxan-2-yl)oxymethyl)oxan-2-yl)oxybut-1-enyl)cyclohex-2-en-1-one
    • (4R)-3,5,5-trimethyl-4-[(E,3R)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxybut-1-enyl]cyclohex-2-en-1-one
    • CHEBI:182937
    • C17888
    • (2R,3E)-4-[(1R)-2,6,6-Trimethyl-4-oxocyclohex-2-en-1-yl]but-3-en-2-yl 6-O-beta-D-xylopyranosyl-beta-D-glucopyranoside
    • 290308-51-9
  • Applications

    Eriojaposide A, CAS 290308-51-9, is a natural product with potential applications in research and industry, including as a natural-product synthesis intermediate and a basis for iridoid-derived compounds; potential odorant component in fragrance or flavor formulations; may be used in cosmetics and personal care as an active ingredient or formulation component; evaluated as a lead scaffold in medicinal chemistry for drug development; and used as an analytical standard or reference material in research laboratories.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1.75
    methanol 15.64
    isopropanol 0.29
    water 0.91
    ethyl acetate 0.32
    n-propanol 0.98
    acetone 1.03
    n-butanol 0.57
    acetonitrile 0.39
    DMF 11.99
    toluene 0.25
    isobutanol 0.32
    1,4-dioxane 2.4
    methyl acetate 0.46
    THF 3.75
    2-butanone 0.82
    n-pentanol 0.44
    sec-butanol 0.33
    n-hexane 0.02
    ethylene glycol 3.31
    NMP 19.39
    cyclohexane 0.04
    DMSO 28.0
    n-butyl acetate 0.14
    n-octanol 0.51
    chloroform 0.42
    n-propyl acetate 0.19
    acetic acid 7.74
    dichloromethane 0.61
    cyclohexanone 1.7
    propylene glycol 3.03
    isopropyl acetate 0.19
    DMAc 13.79
    2-ethoxyethanol 5.52
    isopentanol 0.29
    n-heptane 0.04
    ethyl formate 0.57
    1,2-dichloroethane 0.37
    n-hexanol 0.3
    2-methoxyethanol 12.63
    isobutyl acetate 0.1
    tetrachloromethane 0.07
    n-pentyl acetate 0.44
    transcutol 12.38
    n-heptanol 0.62
    ethylbenzene 0.11
    MIBK 0.33
    2-propoxyethanol 3.66
    tert-butanol 0.18
    MTBE 0.14
    2-butoxyethanol 3.67
    propionic acid 1.24
    o-xylene 0.2
    formic acid 32.14
    diethyl ether 0.33
    m-xylene 0.2
    p-xylene 0.1
    chlorobenzene 0.14
    dimethyl carbonate 0.96
    n-octane 0.03
    formamide 18.42
    cyclopentanone 2.77
    2-pentanone 0.6
    anisole 0.42
    cyclopentyl methyl ether 0.94
    gamma-butyrolactone 3.38
    1-methoxy-2-propanol 4.76
    pyridine 1.54
    3-pentanone 0.56
    furfural 5.03
    n-dodecane 0.02
    diethylene glycol 5.99
    diisopropyl ether 0.06
    tert-amyl alcohol 0.26
    acetylacetone 1.29
    n-hexadecane 0.02
    acetophenone 0.69
    methyl propionate 0.77
    isopentyl acetate 0.14
    trichloroethylene 0.84
    n-nonanol 0.53
    cyclohexanol 0.46
    benzyl alcohol 0.85
    2-ethylhexanol 0.17
    isooctanol 0.37
    dipropyl ether 0.3
    1,2-dichlorobenzene 0.15
    ethyl lactate 0.65
    propylene carbonate 0.82
    n-methylformamide 6.45
    2-pentanol 0.2
    n-pentane 0.02
    1-propoxy-2-propanol 1.59
    1-methoxy-2-propyl acetate 0.83
    2-(2-methoxypropoxy) propanol 2.91
    mesitylene 0.11
    ε-caprolactone 1.6
    p-cymene 0.1
    epichlorohydrin 3.07
    1,1,1-trichloroethane 0.09
    2-aminoethanol 4.67
    morpholine-4-carbaldehyde 14.93
    sulfolane 12.36
    2,2,4-trimethylpentane 0.01
    2-methyltetrahydrofuran 0.96
    n-hexyl acetate 0.57
    isooctane 0.01
    2-(2-butoxyethoxy)ethanol 4.91
    sec-butyl acetate 0.11
    tert-butyl acetate 0.26
    decalin 0.02
    glycerin 12.5
    diglyme 7.84
    acrylic acid 2.81
    isopropyl myristate 0.15
    n-butyric acid 0.91
    acetyl acetate 0.34
    di(2-ethylhexyl) phthalate 0.51
    ethyl propionate 0.23
    nitromethane 6.95
    1,2-diethoxyethane 0.92
    benzonitrile 0.29
    trioctyl phosphate 0.29
    1-bromopropane 0.13
    gamma-valerolactone 9.59
    n-decanol 0.3
    triethyl phosphate 0.22
    4-methyl-2-pentanol 0.11
    propionitrile 0.27
    vinylene carbonate 1.12
    1,1,2-trichlorotrifluoroethane 7.79
    DMS 0.51
    cumene 0.07
    2-octanol 0.25
    2-hexanone 0.35
    octyl acetate 0.33
    limonene 0.14
    1,2-dimethoxyethane 3.44
    ethyl orthosilicate 0.23
    tributyl phosphate 0.22
    diacetone alcohol 1.3
    N,N-dimethylaniline 0.44
    acrylonitrile 0.63
    aniline 0.52
    1,3-propanediol 3.39
    bromobenzene 0.11
    dibromomethane 0.29
    1,1,2,2-tetrachloroethane 0.64
    2-methyl-cyclohexyl acetate 0.29
    tetrabutyl urea 0.52
    diisobutyl methanol 0.09
    2-phenylethanol 0.56
    styrene 0.11
    dioctyl adipate 0.45
    dimethyl sulfate 3.04
    ethyl butyrate 0.2
    methyl lactate 2.45
    butyl lactate 0.9
    diethyl carbonate 0.11
    propanediol butyl ether 4.41
    triethyl orthoformate 0.28
    p-tert-butyltoluene 0.09
    methyl 4-tert-butylbenzoate 1.53
    morpholine 3.51
    tert-butylamine 0.06
    n-dodecanol 0.17
    dimethoxymethane 5.38
    ethylene carbonate 0.62
    cyrene 6.86
    2-ethoxyethyl acetate 1.21
    2-ethylhexyl acetate 0.12
    1,2,4-trichlorobenzene 0.23
    4-methylpyridine 0.71
    dibutyl ether 0.21
    2,6-dimethyl-4-heptanol 0.09
    DEF 1.83
    dimethyl isosorbide 4.67
    tetrachloroethylene 0.59
    eugenol 2.0
    triacetin 1.42
    span 80 2.75
    1,4-butanediol 1.37
    1,1-dichloroethane 0.1
    2-methyl-1-pentanol 0.3
    methyl formate 4.24
    2-methyl-1-butanol 0.39
    n-decane 0.04
    butyronitrile 0.21
    3,7-dimethyl-1-octanol 0.24
    1-chlorooctane 0.13
    1-chlorotetradecane 0.04
    n-nonane 0.03
    undecane 0.02
    tert-butylcyclohexane 0.01
    cyclooctane 0.02
    cyclopentanol 0.6
    tetrahydropyran 0.81
    tert-amyl methyl ether 0.24
    2,5,8-trioxanonane 5.67
    1-hexene 0.05
    2-isopropoxyethanol 1.95
    2,2,2-trifluoroethanol 2.7
    methyl butyrate 0.34

    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