ganolucidic acid D

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  • Identifiers

    CAS number
    102607-22-7

    Molecular formula
    C30H44O6

    SMILES
    C[C@H](C[C@@H](/C=C(\C)/C(=O)O)O)[C@H]1C[C@@H]([C@@]2([C@@]1(CC(=O)C3=C2CC[C@@H]4[C@@]3(CCC(=O)C4(C)C)C)C)C)O

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  • Odor profile

    Fragrance
    Woody 67.59%
    Amber 36.63%
    Cedar 36.24%
    Dry 35.82%
    Odorless 35.14%
    Musk 28.13%
    Balsamic 27.64%
    Spicy 25.43%
    Mint 25.4%
    Warm 24.49%

     

    Flavor
    Bitter 81.89%
    Odorless 25.62%
    Cedarleaf 22.33%
    Bland 22.22%
    Sweet-like 20.3%
    Parsley 20.12%
    Ripe apricot 20.08%
    Heather 20.07%
    Broom 19.93%
    Red fruit 19.75%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    3.7

    pKa est.
    4.98 (weak acid)

    Molecular weight
    500.7 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    314°C

    Flash point

    • 288.44 ˚C est.

  • Synonyms

    • Ganolucidic acid D
    • (+)-Ganolucidic acid D
    • NJ101O0321
    • UNII-NJ101O0321
    • CHEBI:156195
    • (15alpha,23S,24E)-15,23-Dihydroxy-3,11-dioxolanosta-8,24-dien-26-oic acid
    • (23S,24E)-15alpha,23-dihydroxy-3,11-dioxolanosta-8,24-dien-26-oic acid
    • Lanosta-8,24-dien-26-oic acid, 15,23-dihydroxy-3,11-dioxo-, (15alpha,23S,24E)-
    • (15.ALPHA.,23S,24E)-15,23-DIHYDROXY-3,11-DIOXOLANOSTA-8,24-DIEN-26-OIC ACID
    • (2E,4S,6R)-4-hydroxy-6-[(1R,3S,3aR,5aR,9aS,11aR)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-7,10-dioxo-2,3,3a,4,5,5a,6,7,8,9,9a,10,11,11a-tetradecahydro-1H-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid
    • LANOSTA-8,24-DIEN-26-OIC ACID, 15,23-DIHYDROXY-3,11-DIOXO-, (15.ALPHA.,23S,24E)-
    • Ganolucidate D
    • (2E,4S,6R)-4-hydroxy-6-((1R,3S,3aR,5aR,9aS,11aR)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-7,10-dioxo-2,3,3a,4,5,5a,6,7,8,9,9a,10,11,11a-tetradecahydro-1H-cyclopenta(a)phenanthren-1-yl)-2-methylhept-2-enoic acid
    • RefChem:142569
    • Theaflavin 3,3'-digallic acid
    • 15alpha,23-Dihydroxy-3,11-dioxo-5alpha-lanosta-8,24E-dien-26-oic acid
    • 102607-22-7
    • orb1697116
    • SCHEMBL29934385
    • DTXSID001315812
    • AKOS040751895
    • Q27896970
    • (E,4S,6R)-4-hydroxy-6-[(5R,10S,13R,14R,15S,17R)-15-hydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid
    • 102607-22-7

  • Applications

    Ganolucidic acid D (CAS 102607-22-7) is a natural-product-derived triterpenoid that is primarily studied for its bioactivity. In industrial contexts, potential applications include pharmaceutical research as a lead compound and a tool for structure-activity relationship (SAR) studies; inclusion as a bioactive ingredient in cosmetics and personal care formulations; use as an analytical standard or reference material for natural product analysis; and it may be used as an intermediate or building block in organic synthesis.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 32.23
    methanol 55.89
    isopropanol 13.05
    water 0.03
    ethyl acetate 2.83
    n-propanol 21.33
    acetone 12.79
    n-butanol 8.65
    acetonitrile 3.0
    DMF 122.38
    toluene 1.52
    isobutanol 6.9
    1,4-dioxane 29.93
    methyl acetate 4.32
    THF 78.56
    2-butanone 8.66
    n-pentanol 5.56
    sec-butanol 4.05
    n-hexane 0.09
    ethylene glycol 6.4
    NMP 46.69
    cyclohexane 0.09
    DMSO 58.8
    n-butyl acetate 2.26
    n-octanol 1.28
    chloroform 11.34
    n-propyl acetate 2.22
    acetic acid 18.0
    dichloromethane 7.55
    cyclohexanone 12.51
    propylene glycol 10.49
    isopropyl acetate 2.06
    DMAc 47.79
    2-ethoxyethanol 27.7
    isopentanol 3.63
    n-heptane 0.05
    ethyl formate 3.7
    1,2-dichloroethane 4.15
    n-hexanol 4.6
    2-methoxyethanol 67.41
    isobutyl acetate 1.5
    tetrachloromethane 1.13
    n-pentyl acetate 3.07
    transcutol 16.82
    n-heptanol 2.79
    ethylbenzene 0.73
    MIBK 2.72
    2-propoxyethanol 38.85
    tert-butanol 4.98
    MTBE 1.81
    2-butoxyethanol 15.84
    propionic acid 6.56
    o-xylene 0.73
    formic acid 14.88
    diethyl ether 3.62
    m-xylene 0.83
    p-xylene 0.9
    chlorobenzene 1.84
    dimethyl carbonate 5.24
    n-octane 0.03
    formamide 18.34
    cyclopentanone 28.9
    2-pentanone 5.23
    anisole 2.87
    cyclopentyl methyl ether 6.53
    gamma-butyrolactone 25.46
    1-methoxy-2-propanol 37.69
    pyridine 16.53
    3-pentanone 3.59
    furfural 17.68
    n-dodecane 0.01
    diethylene glycol 30.27
    diisopropyl ether 0.44
    tert-amyl alcohol 2.49
    acetylacetone 6.59
    n-hexadecane 0.02
    acetophenone 3.35
    methyl propionate 5.29
    isopentyl acetate 2.07
    trichloroethylene 10.08
    n-nonanol 1.38
    cyclohexanol 2.56
    benzyl alcohol 5.69
    2-ethylhexanol 1.09
    isooctanol 1.69
    dipropyl ether 1.56
    1,2-dichlorobenzene 1.53
    ethyl lactate 2.99
    propylene carbonate 6.0
    n-methylformamide 38.94
    2-pentanol 2.08
    n-pentane 0.09
    1-propoxy-2-propanol 14.08
    1-methoxy-2-propyl acetate 6.57
    2-(2-methoxypropoxy) propanol 6.26
    mesitylene 0.39
    ε-caprolactone 9.15
    p-cymene 0.35
    epichlorohydrin 31.55
    1,1,1-trichloroethane 2.19
    2-aminoethanol 22.93
    morpholine-4-carbaldehyde 60.68
    sulfolane 32.94
    2,2,4-trimethylpentane 0.03
    2-methyltetrahydrofuran 10.87
    n-hexyl acetate 3.0
    isooctane 0.03
    2-(2-butoxyethoxy)ethanol 10.13
    sec-butyl acetate 1.17
    tert-butyl acetate 2.18
    decalin 0.06
    glycerin 17.82
    diglyme 19.08
    acrylic acid 8.02
    isopropyl myristate 0.57
    n-butyric acid 7.05
    acetyl acetate 2.15
    di(2-ethylhexyl) phthalate 1.92
    ethyl propionate 1.8
    nitromethane 21.43
    1,2-diethoxyethane 3.62
    benzonitrile 3.04
    trioctyl phosphate 1.12
    1-bromopropane 1.62
    gamma-valerolactone 59.91
    n-decanol 0.65
    triethyl phosphate 1.06
    4-methyl-2-pentanol 1.13
    propionitrile 3.48
    vinylene carbonate 7.42
    1,1,2-trichlorotrifluoroethane 22.78
    DMS 3.27
    cumene 0.44
    2-octanol 1.02
    2-hexanone 3.67
    octyl acetate 1.11
    limonene 0.43
    1,2-dimethoxyethane 26.79
    ethyl orthosilicate 1.05
    tributyl phosphate 0.91
    diacetone alcohol 5.99
    N,N-dimethylaniline 2.12
    acrylonitrile 5.97
    aniline 3.9
    1,3-propanediol 29.36
    bromobenzene 1.38
    dibromomethane 3.9
    1,1,2,2-tetrachloroethane 8.04
    2-methyl-cyclohexyl acetate 1.92
    tetrabutyl urea 1.67
    diisobutyl methanol 0.49
    2-phenylethanol 5.78
    styrene 0.81
    dioctyl adipate 1.5
    dimethyl sulfate 10.06
    ethyl butyrate 1.44
    methyl lactate 8.04
    butyl lactate 4.55
    diethyl carbonate 0.93
    propanediol butyl ether 11.15
    triethyl orthoformate 1.61
    p-tert-butyltoluene 0.34
    methyl 4-tert-butylbenzoate 4.57
    morpholine 49.27
    tert-butylamine 1.18
    n-dodecanol 0.32
    dimethoxymethane 50.53
    ethylene carbonate 5.1
    cyrene 12.08
    2-ethoxyethyl acetate 6.66
    2-ethylhexyl acetate 1.45
    1,2,4-trichlorobenzene 2.5
    4-methylpyridine 8.87
    dibutyl ether 0.61
    2,6-dimethyl-4-heptanol 0.49
    DEF 7.47
    dimethyl isosorbide 11.03
    tetrachloroethylene 5.93
    eugenol 6.35
    triacetin 3.79
    span 80 6.02
    1,4-butanediol 9.46
    1,1-dichloroethane 2.93
    2-methyl-1-pentanol 2.57
    methyl formate 18.08
    2-methyl-1-butanol 3.58
    n-decane 0.04
    butyronitrile 2.92
    3,7-dimethyl-1-octanol 0.78
    1-chlorooctane 0.29
    1-chlorotetradecane 0.06
    n-nonane 0.04
    undecane 0.02
    tert-butylcyclohexane 0.05
    cyclooctane 0.03
    cyclopentanol 7.29
    tetrahydropyran 11.23
    tert-amyl methyl ether 1.29
    2,5,8-trioxanonane 10.21
    1-hexene 0.5
    2-isopropoxyethanol 10.28
    2,2,2-trifluoroethanol 5.77
    methyl butyrate 2.57

    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