Ecliptasaponin A

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  • Identifiers

    CAS number
    78285-90-2

    Molecular formula
    C36H58O9

    SMILES
    C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(C[C@H]([C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)O)C)C)(C)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O

    Safety labels

  • Odor profile

    Fragrance
    Woody 65.51%
    Amber 41.68%
    Balsamic 41.24%
    Spicy 40.29%
    Dry 36.84%
    Cedar 34.66%
    Odorless 32.41%
    Sweet 32.08%
    Sandalwood 28.89%
    Camphoreous 28.44%

     

    Flavor
    Bitter 52.51%
    Woody 36.82%
    Pine 34.08%
    Balsam 30.57%
    Herbal 30.39%
    Camphor 30.19%
    Sweet 28.93%
    Earthy 23.54%
    Odorless 23.36%
    Patchouli 23.33%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    5.3

    pKa est.
    4.13 (weak acid)

    Molecular weight
    634.8 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    220°C

    Flash point

    • 284.61 ˚C est.

  • Synonyms

    • Ecliptasaponin A
    • (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
    • (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
    • RefChem:136261
    • 78285-90-2
    • Eclalbasaponin II
    • Echinocystic acid-3-o-glucoside
    • MFCD00017386
    • (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
    • Echinocystic acid 3-glucoside
    • Ecliptasaponin A (Standard)
    • CHEMBL3343916
    • SCHEMBL30819178
    • HY-N1508R
    • DTXSID10999638
    • CHEBI:184046
    • HY-N1508
    • MSK183353
    • s9403
    • 3beta-(beta-D-Glucopyranosyloxy)-16alpha-hydroxyolean-12-en-28-oic acid
    • AKOS040750442
    • Eclalbasaponin II, analytical standard
    • CCG-270299
    • AC-34295
    • CS-0017051
    • NS00058414
    • Echinocystic acid 3-O-.beta.-D-glucopyranoside
    • A839703
    • (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-5-oxidanyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
    • (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
    • Ecliptasaponin A(4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid; Echinocystic acid 3-glucoside; Gleditsoside B
    • 78285-90-2

  • Applications

    Ecliptasaponin A is a natural saponin with surface-active properties, commonly evaluated for use as a surfactant and emulsifier in cosmetic and personal care formulations, and as a foaming and cleansing agent in household cleaning products. It can function as a wetting and stabilizing additive in coatings and inks, improving spreading and pigment suspension. In industrial manufacturing, it is used as a processing aid and emulsifier in formulated products and cleaners. It is also explored as an agricultural adjuvant to enhance spray deposition and uptake of agrochemicals. Additionally, it has been studied for pharmaceutical and biotech applications as a bioactive glycoside, but applications remain subject to formulation constraints and local regulations.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 4.3
    methanol 18.89
    isopropanol 1.09
    water 0.02
    ethyl acetate 1.82
    n-propanol 2.63
    acetone 3.9
    n-butanol 1.26
    acetonitrile 0.71
    DMF 32.67
    toluene 1.25
    isobutanol 1.0
    1,4-dioxane 13.5
    methyl acetate 1.95
    THF 39.74
    2-butanone 3.27
    n-pentanol 1.24
    sec-butanol 0.75
    n-hexane 0.06
    ethylene glycol 2.05
    NMP 41.93
    cyclohexane 0.09
    DMSO 25.04
    n-butyl acetate 1.14
    n-octanol 0.83
    chloroform 4.34
    n-propyl acetate 1.04
    acetic acid 12.83
    dichloromethane 3.38
    cyclohexanone 5.82
    propylene glycol 3.41
    isopropyl acetate 1.36
    DMAc 27.11
    2-ethoxyethanol 10.88
    isopentanol 0.79
    n-heptane 0.06
    ethyl formate 1.89
    1,2-dichloroethane 1.86
    n-hexanol 1.19
    2-methoxyethanol 25.95
    isobutyl acetate 0.72
    tetrachloromethane 0.56
    n-pentyl acetate 2.1
    transcutol 16.92
    n-heptanol 1.32
    ethylbenzene 0.5
    MIBK 1.51
    2-propoxyethanol 15.57
    tert-butanol 0.82
    MTBE 0.96
    2-butoxyethanol 8.58
    propionic acid 2.91
    o-xylene 0.74
    formic acid 11.32
    diethyl ether 1.41
    m-xylene 0.87
    p-xylene 0.51
    chlorobenzene 1.01
    dimethyl carbonate 4.12
    n-octane 0.03
    formamide 9.76
    cyclopentanone 15.27
    2-pentanone 2.4
    anisole 1.88
    cyclopentyl methyl ether 5.58
    gamma-butyrolactone 16.65
    1-methoxy-2-propanol 13.65
    pyridine 7.29
    3-pentanone 1.95
    furfural 12.93
    n-dodecane 0.02
    diethylene glycol 12.38
    diisopropyl ether 0.3
    tert-amyl alcohol 0.77
    acetylacetone 5.43
    n-hexadecane 0.02
    acetophenone 2.48
    methyl propionate 3.08
    isopentyl acetate 1.15
    trichloroethylene 5.55
    n-nonanol 0.88
    cyclohexanol 1.05
    benzyl alcohol 2.81
    2-ethylhexanol 0.53
    isooctanol 0.9
    dipropyl ether 1.05
    1,2-dichlorobenzene 0.97
    ethyl lactate 1.81
    propylene carbonate 4.28
    n-methylformamide 12.76
    2-pentanol 0.53
    n-pentane 0.06
    1-propoxy-2-propanol 6.4
    1-methoxy-2-propyl acetate 5.16
    2-(2-methoxypropoxy) propanol 5.04
    mesitylene 0.43
    ε-caprolactone 5.95
    p-cymene 0.34
    epichlorohydrin 16.17
    1,1,1-trichloroethane 0.98
    2-aminoethanol 5.75
    morpholine-4-carbaldehyde 44.34
    sulfolane 32.13
    2,2,4-trimethylpentane 0.04
    2-methyltetrahydrofuran 6.19
    n-hexyl acetate 2.15
    isooctane 0.03
    2-(2-butoxyethoxy)ethanol 7.86
    sec-butyl acetate 0.7
    tert-butyl acetate 1.89
    decalin 0.06
    glycerin 9.5
    diglyme 15.11
    acrylic acid 4.95
    isopropyl myristate 0.45
    n-butyric acid 3.15
    acetyl acetate 1.87
    di(2-ethylhexyl) phthalate 1.14
    ethyl propionate 1.04
    nitromethane 13.48
    1,2-diethoxyethane 2.7
    benzonitrile 1.08
    trioctyl phosphate 0.73
    1-bromopropane 0.64
    gamma-valerolactone 37.87
    n-decanol 0.44
    triethyl phosphate 0.78
    4-methyl-2-pentanol 0.42
    propionitrile 0.71
    vinylene carbonate 4.64
    1,1,2-trichlorotrifluoroethane 19.88
    DMS 2.31
    cumene 0.32
    2-octanol 0.51
    2-hexanone 1.45
    octyl acetate 0.87
    limonene 0.46
    1,2-dimethoxyethane 10.94
    ethyl orthosilicate 0.8
    tributyl phosphate 0.57
    diacetone alcohol 4.45
    N,N-dimethylaniline 1.72
    acrylonitrile 1.55
    aniline 1.9
    1,3-propanediol 5.65
    bromobenzene 0.91
    dibromomethane 1.72
    1,1,2,2-tetrachloroethane 4.27
    2-methyl-cyclohexyl acetate 1.33
    tetrabutyl urea 1.08
    diisobutyl methanol 0.3
    2-phenylethanol 2.75
    styrene 0.52
    dioctyl adipate 1.09
    dimethyl sulfate 8.66
    ethyl butyrate 0.97
    methyl lactate 5.95
    butyl lactate 3.04
    diethyl carbonate 0.58
    propanediol butyl ether 8.04
    triethyl orthoformate 1.23
    p-tert-butyltoluene 0.39
    methyl 4-tert-butylbenzoate 4.39
    morpholine 18.43
    tert-butylamine 0.27
    n-dodecanol 0.23
    dimethoxymethane 23.47
    ethylene carbonate 3.06
    cyrene 11.34
    2-ethoxyethyl acetate 5.2
    2-ethylhexyl acetate 0.89
    1,2,4-trichlorobenzene 1.61
    4-methylpyridine 3.73
    dibutyl ether 0.46
    2,6-dimethyl-4-heptanol 0.3
    DEF 4.66
    dimethyl isosorbide 10.4
    tetrachloroethylene 3.57
    eugenol 4.63
    triacetin 3.78
    span 80 5.15
    1,4-butanediol 1.99
    1,1-dichloroethane 1.01
    2-methyl-1-pentanol 0.8
    methyl formate 9.06
    2-methyl-1-butanol 0.83
    n-decane 0.04
    butyronitrile 0.59
    3,7-dimethyl-1-octanol 0.53
    1-chlorooctane 0.25
    1-chlorotetradecane 0.06
    n-nonane 0.04
    undecane 0.03
    tert-butylcyclohexane 0.05
    cyclooctane 0.05
    cyclopentanol 2.36
    tetrahydropyran 4.63
    tert-amyl methyl ether 0.89
    2,5,8-trioxanonane 8.44
    1-hexene 0.21
    2-isopropoxyethanol 4.54
    2,2,2-trifluoroethanol 3.53
    methyl butyrate 1.43

    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