Artonin L

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  • Identifiers

    CAS number
    148719-52-2

    Molecular formula
    C22H20O7

    SMILES
    CC1(C2CC3=C(C4=C(C=C(C(=C24)O1)O)OC)OC5=CC(=CC(=C5C3=O)O)OC)C

    Safety labels

  • Odor profile

    Fragrance
    Phenolic 48.76%
    Spicy 35.32%
    Woody 34.82%
    Odorless 34.51%
    Sweet 28.13%
    Dry 26.48%
    Powdery 26.39%
    Smoky 25.96%
    Balsamic 25.18%
    Fruity 24.95%

     

    Flavor
    Bitter 94.61%
    Bland 24.31%
    Cedarleaf 20.1%
    Parsley 19.97%
    Sweet-like 19.02%
    Odorless 18.78%
    Lovage 18.59%
    Ripe apricot 18.47%
    Red fruit 18.19%
    Eugenol 18.07%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    3.4

    pKa est.
    8.35 (weak base)

    Molecular weight
    396.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    1513°C

    Melting point expt.

    • 249 - 250 °C

    Flash point

    • 257.17 ˚C est.

  • Synonyms

    • Artonin L
    • CHEBI:175165
    • DTXSID101119007
    • LMPK12111520
    • 148719-52-2
    • 8,17-dihydroxy-6,19-dimethoxy-14,14-dimethyl-3,15-dioxapentacyclo[11.6.1.02,11.04,9.016,20]icosa-1(19),2(11),4,6,8,16(20),17-heptaen-10-one
    • 3,8-Dihydroxy-1,10-dimethoxy-5,5-dimethyl-5a,6-dihydro-5H,7H-[1]benzofuro[3,4-bc]xanthen-7-one
    • 5a,6-Dihydro-3,8-dihydroxy-1,10-dimethoxy-5,5-dimethyl-5H,7H-benzofuro[3,4-bc]xanthen-7-one
    • 5H,7H-Benzofuro[3,4-bc]xanthen-7-one, 5a,6-dihydro-3,8-dihydroxy-1,10-dimethoxy-5,5-dimethyl-
    • 148719-52-2

  • Applications

    Artonin L is a natural xanthone derivative that is primarily encountered in pharmaceutical research as a bioactive lead compound explored in target discovery and early-stage studies, and it also serves as a chemical synthesis intermediate for organic routes. In cosmetics/personal care, it is investigated as a potential antioxidant or functional ingredient in formulations. In laboratory and industrial settings, it is used as a research reagent for isolation, characterization, and SAR studies, providing a scaffold for structure–activity relationship work. It may also be considered in screening programs for derivative development, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 0.58
    methanol 1.01
    isopropanol 0.58
    water 0.01
    ethyl acetate 5.57
    n-propanol 0.75
    acetone 8.52
    n-butanol 0.71
    acetonitrile 4.9
    DMF 32.43
    toluene 0.78
    isobutanol 0.74
    1,4-dioxane 11.58
    methyl acetate 8.26
    THF 24.84
    2-butanone 7.4
    n-pentanol 0.69
    sec-butanol 0.5
    n-hexane 0.02
    ethylene glycol 1.69
    NMP 55.16
    cyclohexane 0.05
    DMSO 55.8
    n-butyl acetate 6.55
    n-octanol 1.12
    chloroform 17.72
    n-propyl acetate 5.75
    acetic acid 12.4
    dichloromethane 14.6
    cyclohexanone 17.48
    propylene glycol 0.93
    isopropyl acetate 4.27
    DMAc 53.43
    2-ethoxyethanol 5.71
    isopentanol 0.97
    n-heptane 0.03
    ethyl formate 5.53
    1,2-dichloroethane 8.74
    n-hexanol 0.77
    2-methoxyethanol 10.64
    isobutyl acetate 4.85
    tetrachloromethane 1.13
    n-pentyl acetate 5.3
    transcutol 14.88
    n-heptanol 1.18
    ethylbenzene 0.52
    MIBK 3.73
    2-propoxyethanol 12.5
    tert-butanol 1.14
    MTBE 0.84
    2-butoxyethanol 7.83
    propionic acid 4.45
    o-xylene 0.64
    formic acid 7.41
    diethyl ether 0.77
    m-xylene 0.61
    p-xylene 1.12
    chlorobenzene 2.89
    dimethyl carbonate 13.28
    n-octane 0.03
    formamide 10.74
    cyclopentanone 30.91
    2-pentanone 4.54
    anisole 2.56
    cyclopentyl methyl ether 3.88
    gamma-butyrolactone 45.88
    1-methoxy-2-propanol 7.25
    pyridine 10.99
    3-pentanone 4.39
    furfural 33.84
    n-dodecane 0.05
    diethylene glycol 16.89
    diisopropyl ether 0.33
    tert-amyl alcohol 0.87
    acetylacetone 14.37
    n-hexadecane 0.07
    acetophenone 7.09
    methyl propionate 7.65
    isopentyl acetate 7.15
    trichloroethylene 31.93
    n-nonanol 1.37
    cyclohexanol 1.36
    benzyl alcohol 3.62
    2-ethylhexanol 0.98
    isooctanol 1.29
    dipropyl ether 1.31
    1,2-dichlorobenzene 4.09
    ethyl lactate 6.15
    propylene carbonate 20.08
    n-methylformamide 10.69
    2-pentanol 0.37
    n-pentane 0.01
    1-propoxy-2-propanol 7.52
    1-methoxy-2-propyl acetate 14.11
    2-(2-methoxypropoxy) propanol 10.14
    mesitylene 0.39
    ε-caprolactone 17.13
    p-cymene 0.88
    epichlorohydrin 38.86
    1,1,1-trichloroethane 7.33
    2-aminoethanol 1.51
    morpholine-4-carbaldehyde 44.89
    sulfolane 75.69
    2,2,4-trimethylpentane 0.03
    2-methyltetrahydrofuran 6.16
    n-hexyl acetate 5.14
    isooctane 0.02
    2-(2-butoxyethoxy)ethanol 10.61
    sec-butyl acetate 3.47
    tert-butyl acetate 4.84
    decalin 0.07
    glycerin 5.55
    diglyme 22.06
    acrylic acid 8.27
    isopropyl myristate 2.78
    n-butyric acid 5.36
    acetyl acetate 8.55
    di(2-ethylhexyl) phthalate 5.08
    ethyl propionate 5.41
    nitromethane 45.85
    1,2-diethoxyethane 4.98
    benzonitrile 7.21
    trioctyl phosphate 3.53
    1-bromopropane 1.44
    gamma-valerolactone 54.67
    n-decanol 1.05
    triethyl phosphate 5.77
    4-methyl-2-pentanol 0.55
    propionitrile 4.06
    vinylene carbonate 21.5
    1,1,2-trichlorotrifluoroethane 43.47
    DMS 11.65
    cumene 0.48
    2-octanol 0.76
    2-hexanone 4.66
    octyl acetate 3.59
    limonene 0.91
    1,2-dimethoxyethane 14.66
    ethyl orthosilicate 4.35
    tributyl phosphate 4.23
    diacetone alcohol 8.54
    N,N-dimethylaniline 2.17
    acrylonitrile 10.01
    aniline 2.19
    1,3-propanediol 2.95
    bromobenzene 2.67
    dibromomethane 5.73
    1,1,2,2-tetrachloroethane 21.61
    2-methyl-cyclohexyl acetate 6.9
    tetrabutyl urea 6.62
    diisobutyl methanol 0.89
    2-phenylethanol 5.02
    styrene 0.64
    dioctyl adipate 5.68
    dimethyl sulfate 33.65
    ethyl butyrate 5.48
    methyl lactate 10.13
    butyl lactate 6.46
    diethyl carbonate 5.61
    propanediol butyl ether 5.89
    triethyl orthoformate 5.39
    p-tert-butyltoluene 0.76
    methyl 4-tert-butylbenzoate 8.96
    morpholine 11.31
    tert-butylamine 0.33
    n-dodecanol 0.81
    dimethoxymethane 14.57
    ethylene carbonate 17.32
    cyrene 19.44
    2-ethoxyethyl acetate 10.87
    2-ethylhexyl acetate 5.62
    1,2,4-trichlorobenzene 7.11
    4-methylpyridine 7.7
    dibutyl ether 1.32
    2,6-dimethyl-4-heptanol 0.89
    DEF 9.18
    dimethyl isosorbide 24.84
    tetrachloroethylene 11.55
    eugenol 9.74
    triacetin 11.9
    span 80 7.04
    1,4-butanediol 1.34
    1,1-dichloroethane 5.01
    2-methyl-1-pentanol 0.87
    methyl formate 13.01
    2-methyl-1-butanol 0.76
    n-decane 0.07
    butyronitrile 2.68
    3,7-dimethyl-1-octanol 1.35
    1-chlorooctane 0.53
    1-chlorotetradecane 0.31
    n-nonane 0.05
    undecane 0.06
    tert-butylcyclohexane 0.05
    cyclooctane 0.02
    cyclopentanol 2.31
    tetrahydropyran 3.69
    tert-amyl methyl ether 0.85
    2,5,8-trioxanonane 17.42
    1-hexene 0.13
    2-isopropoxyethanol 4.45
    2,2,2-trifluoroethanol 10.13
    methyl butyrate 7.3

    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