Notoginsenoside Fc

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  • Identifiers

    CAS number
    88122-52-5

    Molecular formula
    C58H98O26

    SMILES
    CC(=CCC[C@@](C)([C@H]1CC[C@@]2([C@@H]1[C@@H](C[C@H]3[C@]2(CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O[C@H]7[C@@H]([C@H]([C@@H](CO7)O)O)O)C)C)O)C)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO[C@H]9[C@@H]([C@H]([C@@H](CO9)O)O)O)O)O)O)C

    Safety labels

  • Odor profile

    Fragrance
    Odorless 54.54%
    Sweet 40.44%
    Woody 37.66%
    Spicy 26.99%
    Cooling 25.33%
    Mint 23.71%
    Balsamic 22.84%
    Amber 22.02%
    Warm 21.39%
    Dry 21.0%

     

    Flavor
    Bitter 47.21%
    Sweet 41.11%
    Odorless 33.8%
    Fatty 32.15%
    Sweet-like 27.94%
    Bland 23.08%
    Cedarleaf 21.14%
    Mentholic 21.07%
    Metallic 20.74%
    Patchouli 20.56%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    -1.2

    pKa est.
    4.09 (weak acid)

    Molecular weight
    1211.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    3590°C

    Flash point

    • 188.95 ˚C est.

  • Synonyms

    • Notoginsenoside Fc
    • 88122-52-5
    • DTXSID301316021
    • notoginsenoside-Fc
    • RefChem:166837
    • DTXCID001745897
    • (2S,3R,4S,5S,6R)-2-((2S)-2-((3S,5R,8R,9R,10R,12R,13R,14R,17S)-3-((2R,3R,4S,5S,6R)-3-((2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-((2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl)oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy-12-hydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta(a)phenanthren-17-yl)-6-methylhept-5-en-2-yl)oxy-6-(((2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl)oxymethyl)oxane-3,4,5-triol
    • NotoginsenosideFc
    • orb1303384
    • SCHEMBL29414372
    • HY-N2531
    • MSK181368
    • AKOS030530158
    • EBC-615511
    • FN74238
    • AC-34758
    • DA-56273
    • MS-32053
    • CS-0022802
    • 12beta-Hydroxy-20-[(6-O-beta-D-xylopyranosyl-beta-D-glucopyranosyl)oxy]dammar-24-en-3beta-yl beta-D-xylopyranosyl-(1->2)-beta-D-glucopyranosyl-(1->2)-beta-D-glucopyranoside
    • 88122-52-5

  • Applications

    Notoginsenoside Fc is a natural dammarane-type saponin isolated from Panax notoginseng. In industrial contexts, its applications are largely in research and development and analytical workflows: it is commonly used as a reference material for isolation, structure elucidation, and method development of notoginsenosides in Panax notoginseng extracts; it serves as a lead structure for pharmacological investigations and SAR studies of ginseng saponins in the pharmaceutical/natural products field; it may be explored for cosmetic and personal care formulations given the surface-active, foaming characteristics of saponins, either as an active ingredient or as a surfactant component in formulations; it may be considered for cleaning formulations as a natural surfactant; and it can function as an intermediate or building block in the synthesis of related ginsenosides. All uses should be subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1.18
    methanol 14.07
    isopropanol 0.34
    water 0.16
    ethyl acetate 1.22
    n-propanol 0.6
    acetone 2.79
    n-butanol 0.25
    acetonitrile 1.21
    DMF 35.36
    toluene 0.32
    isobutanol 0.24
    1,4-dioxane 5.26
    methyl acetate 1.77
    THF 7.49
    2-butanone 1.42
    n-pentanol 0.25
    sec-butanol 0.21
    n-hexane 0.01
    ethylene glycol 3.28
    NMP 32.16
    cyclohexane 0.03
    DMSO 38.66
    n-butyl acetate 0.59
    n-octanol 0.48
    chloroform 2.12
    n-propyl acetate 0.68
    acetic acid 17.27
    dichloromethane 2.3
    cyclohexanone 1.85
    propylene glycol 2.08
    isopropyl acetate 0.73
    DMAc 28.1
    2-ethoxyethanol 4.99
    isopentanol 0.15
    n-heptane 0.03
    ethyl formate 1.49
    1,2-dichloroethane 0.99
    n-hexanol 0.23
    2-methoxyethanol 10.64
    isobutyl acetate 0.36
    tetrachloromethane 0.25
    n-pentyl acetate 1.25
    transcutol 11.17
    n-heptanol 0.54
    ethylbenzene 0.14
    MIBK 0.53
    2-propoxyethanol 4.89
    tert-butanol 0.26
    MTBE 0.28
    2-butoxyethanol 4.32
    propionic acid 1.99
    o-xylene 0.25
    formic acid 32.63
    diethyl ether 0.45
    m-xylene 0.25
    p-xylene 0.19
    chlorobenzene 0.4
    dimethyl carbonate 5.16
    n-octane 0.02
    formamide 21.38
    cyclopentanone 4.82
    2-pentanone 0.91
    anisole 0.84
    cyclopentyl methyl ether 1.25
    gamma-butyrolactone 8.98
    1-methoxy-2-propanol 4.94
    pyridine 3.13
    3-pentanone 0.93
    furfural 13.59
    n-dodecane 0.01
    diethylene glycol 7.72
    diisopropyl ether 0.1
    tert-amyl alcohol 0.22
    acetylacetone 4.4
    n-hexadecane 0.02
    acetophenone 1.51
    methyl propionate 2.25
    isopentyl acetate 0.47
    trichloroethylene 3.79
    n-nonanol 0.5
    cyclohexanol 0.23
    benzyl alcohol 0.97
    2-ethylhexanol 0.14
    isooctanol 0.33
    dipropyl ether 0.49
    1,2-dichlorobenzene 0.51
    ethyl lactate 1.58
    propylene carbonate 3.16
    n-methylformamide 13.07
    2-pentanol 0.12
    n-pentane 0.02
    1-propoxy-2-propanol 2.6
    1-methoxy-2-propyl acetate 2.93
    2-(2-methoxypropoxy) propanol 3.59
    mesitylene 0.13
    ε-caprolactone 2.2
    p-cymene 0.15
    epichlorohydrin 6.84
    1,1,1-trichloroethane 0.52
    2-aminoethanol 3.06
    morpholine-4-carbaldehyde 30.69
    sulfolane 24.09
    2,2,4-trimethylpentane 0.01
    2-methyltetrahydrofuran 1.15
    n-hexyl acetate 1.22
    isooctane 0.01
    2-(2-butoxyethoxy)ethanol 5.12
    sec-butyl acetate 0.35
    tert-butyl acetate 0.82
    decalin 0.02
    glycerin 8.69
    diglyme 11.38
    acrylic acid 5.44
    isopropyl myristate 0.3
    n-butyric acid 1.27
    acetyl acetate 2.16
    di(2-ethylhexyl) phthalate 0.73
    ethyl propionate 0.71
    nitromethane 31.31
    1,2-diethoxyethane 1.64
    benzonitrile 0.8
    trioctyl phosphate 0.46
    1-bromopropane 0.2
    gamma-valerolactone 18.52
    n-decanol 0.28
    triethyl phosphate 0.6
    4-methyl-2-pentanol 0.09
    propionitrile 0.56
    vinylene carbonate 4.57
    1,1,2-trichlorotrifluoroethane 18.96
    DMS 2.11
    cumene 0.1
    2-octanol 0.26
    2-hexanone 0.6
    octyl acetate 0.61
    limonene 0.17
    1,2-dimethoxyethane 6.07
    ethyl orthosilicate 0.51
    tributyl phosphate 0.38
    diacetone alcohol 2.01
    N,N-dimethylaniline 0.81
    acrylonitrile 1.8
    aniline 0.59
    1,3-propanediol 1.88
    bromobenzene 0.36
    dibromomethane 0.79
    1,1,2,2-tetrachloroethane 2.24
    2-methyl-cyclohexyl acetate 0.61
    tetrabutyl urea 0.82
    diisobutyl methanol 0.1
    2-phenylethanol 0.94
    styrene 0.18
    dioctyl adipate 0.82
    dimethyl sulfate 13.95
    ethyl butyrate 0.63
    methyl lactate 5.43
    butyl lactate 1.83
    diethyl carbonate 0.48
    propanediol butyl ether 4.78
    triethyl orthoformate 0.83
    p-tert-butyltoluene 0.16
    methyl 4-tert-butylbenzoate 3.02
    morpholine 4.79
    tert-butylamine 0.08
    n-dodecanol 0.16
    dimethoxymethane 13.8
    ethylene carbonate 2.28
    cyrene 7.96
    2-ethoxyethyl acetate 3.89
    2-ethylhexyl acetate 0.37
    1,2,4-trichlorobenzene 0.86
    4-methylpyridine 1.45
    dibutyl ether 0.27
    2,6-dimethyl-4-heptanol 0.1
    DEF 2.73
    dimethyl isosorbide 7.61
    tetrachloroethylene 1.81
    eugenol 3.31
    triacetin 4.26
    span 80 3.18
    1,4-butanediol 1.01
    1,1-dichloroethane 0.48
    2-methyl-1-pentanol 0.15
    methyl formate 12.77
    2-methyl-1-butanol 0.16
    n-decane 0.03
    butyronitrile 0.3
    3,7-dimethyl-1-octanol 0.23
    1-chlorooctane 0.15
    1-chlorotetradecane 0.04
    n-nonane 0.03
    undecane 0.02
    tert-butylcyclohexane 0.01
    cyclooctane 0.02
    cyclopentanol 0.49
    tetrahydropyran 0.92
    tert-amyl methyl ether 0.29
    2,5,8-trioxanonane 7.34
    1-hexene 0.05
    2-isopropoxyethanol 2.09
    2,2,2-trifluoroethanol 8.29
    methyl butyrate 0.85

    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