Myricitrin

Overview IFRA Request a quote

  • Identifiers

    CAS number
    17912-87-7

    Molecular formula
    C21H20O12

    SMILES
    C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C(=C4)O)O)O)O)O)O

    Safety labels

  • Odor profile

    Fragrance
    Odorless 80.25%
    Phenolic 34.81%
    Burnt 26.53%
    Savory 20.5%
    Smoky 20.26%
    Vanilla 18.24%
    Milky 16.75%
    Bitter 15.42%
    Spicy 14.9%
    Balsamic 14.2%

     

    Flavor
    Bitter 81.59%
    Odorless 35.34%
    Bland 32.06%
    Sweet-like 25.58%
    Cedarleaf 20.33%
    Eugenol 20.04%
    Parsley 19.76%
    Lovage 19.18%
    Nitrile 19.11%
    Mild 18.97%

     

    Odor impact est.
    Odorless

  • Properties

    XLogP3-AA
    0.5

    pKa est.
    8.6 (weak base)

    Molecular weight
    464.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    3215°C

    Flash point

    • 296.49 ˚C est.

    Solubility expt.

    • Practically insoluble to insoluble
    • Slightly Soluble (in ethanol)

  • Synonyms

    • Myricitrin
    • 17912-87-7
    • Myricitroside
    • Myricitrine
    • Myricetin 3-O-rhamnoside
    • Myricetin 3-O-alpha-L-rhamnopyranoside
    • 5Z0ZO61WPJ
    • DTXSID40170771
    • 5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one
    • FEMA NO. 4491
    • CHEBI:70082
    • NSC-19803
    • 5,7-dihydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)-4H-chromen-3-yl 6-deoxy-alpha-L-mannopyranoside
    • 5,7-dihydroxy-3-((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one
    • RefChem:160395
    • 3,3',4',5,5',7-Hexahydroxyflavone 3-Rhamnoside
    • DTXCID5093262
    • 241-856-7
    • Myricetrin
    • Myricetol 3-rhamnoside
    • MFCD00016930
    • Myricetin 3-O-alpha-L-rhamnoside
    • MLS000574998
    • 5,7-dihydroxy-3-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one
    • NSC19803
    • SMR000232363
    • 3-((6-Deoxy-alpha-L-mannopyranosyl)oxy)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-benzopyran-4-one
    • 5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one
    • 3,3',4',5,5',7-Hexahydroxyflavone, 3-rhamnoside
    • 3-[(6-deoxy-alpha-L-mannopyranosyl)oxy]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-1-benzopyran-4-one
    • 4H-1-Benzopyran-4-one, 3-[(6-deoxy-.alpha.-L-mannopyranosyl)oxy]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-
    • Flavone,3,3',4',5,5',7-hexahydroxy-,3-rhamnoside
    • UNII-5Z0ZO61WPJ
    • Myricetin-3-O-alpha-L-rhamnoside
    • myricetin-rhamnoside
    • Myricitrin (7)
    • 4H-1-BENZOPYRAN-4-ONE, 3-((6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL)OXY)-5,7-DIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-
    • Myricetin 3-O-.alpha.-L-rhamnopyranoside
    • EINECS 241-856-7
    • NSC 19803
    • Myricitrin (Standard)
    • myricetin-3-rhamnoside
    • Myricitrin (Myricitrine)
    • 5,7-Dihydroxy-3-((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydro-pyran-2-yloxy)-2-(3,4,5-trihydroxy-phenyl)-1-benzopyran-4-one
    • SCHEMBL226022
    • Myricitrin, analytical standard
    • CHEMBL522983
    • MEGxp0_000257
    • orb1305064
    • SCHEMBL30637444
    • ACon1_000103
    • BDBM34753
    • cid_5281673
    • HY-N0152R
    • BDBM153266
    • HMS2218N08
    • HY-N0152
    • Myricitrin, >=99.0% (HPLC)
    • AC-638
    • MYRICETIN 3-O-RHAMNOPYRANOSIDE
    • AKOS015896842
    • CCG-208406
    • EBC-465054
    • MM08117
    • NCGC00163596-01
    • NCGC00163596-02
    • NCGC00163596-06
    • 5,7-dihydroxy-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one
    • BS-16289
    • SY073681
    • CS-0007883
    • NS00021765
    • S2327
    • MYRICETIN 3-O-.ALPHA.-L-RHAMNPYRONOSIDE
    • 912M877
    • SR-01000712005
    • Myricitrin, primary pharmaceutical reference standard
    • Q6948223
    • SR-01000712005-3
    • 3-[(2S,3R,4R,5R,6S)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-5,7-bis(oxidanyl)-2-[3,4,5-tris(oxidanyl)phenyl]chromen-4-one
    • 3-[(6-deoxy-a-L-mannopyranosyl)oxy]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-benzopyran-4-one
    • 5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2-(3,4,5-trihydroxyphenyl)chromone
    • 5,7-dihydroxy-3-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]-2-(3,4,5-trihydroxyphenyl)-1-benzopyran-4-one
    • 5,7-Dihydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)-4H-1-benzopyran-3-yl 6-deoxy-alpha-L-mannopyranoside
    • 17912-87-7

  • Applications

    Myricitrin (CAS 17912-87-7) is a flavonol glycoside found in a variety of plant sources and produced for industrial applications as an antioxidant and stabilizer in cosmetic and personal-care formulations; it is also used as an intermediate for the synthesis of flavonoid derivatives and often serves as a reference standard or analytical reagent in flavonoid analyses (e.g., HPLC); in food processing and nutraceutical contexts, its antioxidant properties are evaluated as a potential functional ingredient; in materials science, it is being explored as a natural stabilizer for polymers and coatings to improve formulation stability; and its phytochemical activity is the subject of research in agriculture and basic science, with practical use constrained by regulatory and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 8.93
    methanol 12.16
    isopropanol 4.27
    water 0.07
    ethyl acetate 0.35
    n-propanol 10.01
    acetone 0.69
    n-butanol 2.98
    acetonitrile 0.17
    DMF 33.14
    toluene 0.03
    isobutanol 2.01
    1,4-dioxane 3.32
    methyl acetate 0.83
    THF 7.57
    2-butanone 2.25
    n-pentanol 1.03
    sec-butanol 4.28
    n-hexane 0.01
    ethylene glycol 31.86
    NMP 35.24
    cyclohexane 0.01
    DMSO 74.76
    n-butyl acetate 0.21
    n-octanol 0.67
    chloroform 0.02
    n-propyl acetate 0.21
    acetic acid 13.81
    dichloromethane 0.03
    cyclohexanone 1.65
    propylene glycol 43.55
    isopropyl acetate 0.18
    DMAc 35.11
    2-ethoxyethanol 24.83
    isopentanol 0.93
    n-heptane 0.02
    ethyl formate 0.69
    1,2-dichloroethane 0.06
    n-hexanol 0.5
    2-methoxyethanol 92.07
    isobutyl acetate 0.06
    tetrachloromethane 0.01
    n-pentyl acetate 0.39
    transcutol 18.59
    n-heptanol 0.84
    ethylbenzene 0.01
    MIBK 0.2
    2-propoxyethanol 11.07
    tert-butanol 1.52
    MTBE 0.29
    2-butoxyethanol 6.63
    propionic acid 6.0
    o-xylene 0.03
    formic acid 37.8
    diethyl ether 0.46
    m-xylene 0.02
    p-xylene 0.01
    chlorobenzene 0.01
    dimethyl carbonate 1.1
    n-octane 0.01
    formamide 38.36
    cyclopentanone 4.06
    2-pentanone 0.7
    anisole 0.11
    cyclopentyl methyl ether 0.77
    gamma-butyrolactone 6.28
    1-methoxy-2-propanol 44.32
    pyridine 1.15
    3-pentanone 0.49
    furfural 4.15
    n-dodecane 0.01
    diethylene glycol 22.8
    diisopropyl ether 0.04
    tert-amyl alcohol 1.86
    acetylacetone 0.71
    n-hexadecane 0.01
    acetophenone 0.18
    methyl propionate 1.27
    isopentyl acetate 0.16
    trichloroethylene 0.08
    n-nonanol 0.71
    cyclohexanol 1.08
    benzyl alcohol 0.44
    2-ethylhexanol 0.17
    isooctanol 0.41
    dipropyl ether 0.36
    1,2-dichlorobenzene 0.01
    ethyl lactate 1.45
    propylene carbonate 0.78
    n-methylformamide 19.52
    2-pentanol 1.04
    n-pentane 0.02
    1-propoxy-2-propanol 5.85
    1-methoxy-2-propyl acetate 1.23
    2-(2-methoxypropoxy) propanol 4.66
    mesitylene 0.01
    ε-caprolactone 2.38
    p-cymene 0.02
    epichlorohydrin 3.27
    1,1,1-trichloroethane 0.01
    2-aminoethanol 48.82
    morpholine-4-carbaldehyde 32.2
    sulfolane 20.28
    2,2,4-trimethylpentane 0.01
    2-methyltetrahydrofuran 1.72
    n-hexyl acetate 0.5
    isooctane 0.0
    2-(2-butoxyethoxy)ethanol 8.05
    sec-butyl acetate 0.1
    tert-butyl acetate 0.23
    decalin 0.0
    glycerin 95.52
    diglyme 11.92
    acrylic acid 7.55
    isopropyl myristate 0.14
    n-butyric acid 2.59
    acetyl acetate 0.11
    di(2-ethylhexyl) phthalate 0.29
    ethyl propionate 0.23
    nitromethane 8.93
    1,2-diethoxyethane 0.99
    benzonitrile 0.07
    trioctyl phosphate 0.3
    1-bromopropane 0.05
    gamma-valerolactone 21.49
    n-decanol 0.45
    triethyl phosphate 0.21
    4-methyl-2-pentanol 0.23
    propionitrile 0.31
    vinylene carbonate 0.63
    1,1,2-trichlorotrifluoroethane 11.68
    DMS 0.47
    cumene 0.01
    2-octanol 0.41
    2-hexanone 0.29
    octyl acetate 0.34
    limonene 0.04
    1,2-dimethoxyethane 8.24
    ethyl orthosilicate 0.19
    tributyl phosphate 0.23
    diacetone alcohol 2.87
    N,N-dimethylaniline 0.12
    acrylonitrile 0.61
    aniline 0.31
    1,3-propanediol 35.19
    bromobenzene 0.0
    dibromomethane 0.02
    1,1,2,2-tetrachloroethane 0.13
    2-methyl-cyclohexyl acetate 0.17
    tetrabutyl urea 0.61
    diisobutyl methanol 0.09
    2-phenylethanol 0.28
    styrene 0.01
    dioctyl adipate 0.38
    dimethyl sulfate 3.13
    ethyl butyrate 0.21
    methyl lactate 8.89
    butyl lactate 1.64
    diethyl carbonate 0.12
    propanediol butyl ether 8.29
    triethyl orthoformate 0.36
    p-tert-butyltoluene 0.02
    methyl 4-tert-butylbenzoate 0.9
    morpholine 14.06
    tert-butylamine 0.28
    n-dodecanol 0.26
    dimethoxymethane 10.21
    ethylene carbonate 0.45
    cyrene 5.52
    2-ethoxyethyl acetate 1.02
    2-ethylhexyl acetate 0.11
    1,2,4-trichlorobenzene 0.02
    4-methylpyridine 0.31
    dibutyl ether 0.24
    2,6-dimethyl-4-heptanol 0.09
    DEF 2.59
    dimethyl isosorbide 3.9
    tetrachloroethylene 0.09
    eugenol 1.38
    triacetin 1.02
    span 80 4.28
    1,4-butanediol 6.85
    1,1-dichloroethane 0.02
    2-methyl-1-pentanol 0.44
    methyl formate 6.36
    2-methyl-1-butanol 1.46
    n-decane 0.02
    butyronitrile 0.17
    3,7-dimethyl-1-octanol 0.26
    1-chlorooctane 0.06
    1-chlorotetradecane 0.02
    n-nonane 0.02
    undecane 0.01
    tert-butylcyclohexane 0.0
    cyclooctane 0.01
    cyclopentanol 3.04
    tetrahydropyran 1.22
    tert-amyl methyl ether 0.42
    2,5,8-trioxanonane 7.94
    1-hexene 0.03
    2-isopropoxyethanol 5.29
    2,2,2-trifluoroethanol 3.39
    methyl butyrate 0.38

    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