Eritadenine

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  • Identifiers

    CAS number
    23918-98-1

    Molecular formula
    C9H11N5O4

    SMILES
    C1=NC(=C2C(=N1)N(C=N2)C[C@H]([C@H](C(=O)O)O)O)N

    Safety labels

  • Odor profile

    Fragrance
    Odorless 81.7%
    Savory 23.83%
    Sweet 21.22%
    Milky 19.95%
    Bitter 19.61%
    Cooked 17.78%
    Caramellic 15.25%
    Buttery 15.18%
    Meaty 14.95%
    Burnt 13.95%

     

    Flavor
    Bitter 69.01%
    Odorless 65.39%
    Bland 36.86%
    Very mild 28.0%
    Mild 26.39%
    Sweet-like 25.29%
    Yeast 19.5%
    Nitrile 18.47%
    Bread crust 18.29%
    Roasted peanuts 18.05%

     

    Odor impact est.
    Odorless

  • Properties

    XLogP3-AA
    -1.8

    pKa est.
    3.6 (weak acid)

    Molecular weight
    253.22 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    1222°C

    Flash point

    • 355.06 ˚C est.

  • Synonyms

    • Eritadenine
    • d-eritadenine
    • 23918-98-1
    • Lentinacin
    • (2R,3R)-4-(6-aminopurin-9-yl)-2,3-dihydroxybutanoic acid
    • 41T27K4B9F
    • DTXSID00178632
    • 6-amino-alpha,beta-dihydroxy-9H-purine-9-butanoic acid
    • RefChem:591092
    • DTXCID60101123
    • 9H-PURINE-9-BUTANOIC ACID, 6-AMINO-ALPHA,BETA-DIHYDROXY-, (ALPHAR,BETAR)-
    • Lentysine
    • 4-(9-Adenyl)-D-erythro-2,3-dihydroxybutyric acid
    • Leutinacin
    • (2R,3R)-4-(6-amino-9H-purin-9-yl)-2,3-dihydroxybutanoic acid
    • 4-(6-Amino-9H-purin-9-yl)-4-deoxy-D-erythronic Acid
    • CHEMBL1095280
    • MMV689255
    • Lentysine;Lentinacin
    • D-4-(6-Amino-9H-purin-9-yl)-4-deoxyerythronic acid
    • UNII-41T27K4B9F
    • Erythronic acid, 4-(6-amino-9H-purin-9-yl)-4-deoxy-, D-
    • ERITADENINE [MI]
    • 4-(6-Aminopurin-9-yl)-4-deoxy-D-erythronic Acid
    • SCHEMBL308656
    • orb1702297
    • CHEBI:220293
    • BDBM50316222
    • 9H-Purine-9-butanoic acid, 6-amino-alpha,beta-dihydroxy-, (R-(R*,R*))-
    • AKOS030254737
    • DB03769
    • FE22787
    • HY-114866
    • CS-0064520
    • NS00068883
    • A820627
    • SR-05000022549
    • 4-(6-Aminopurin-9-yl)- 4-deoxy-D-erythronic acid
    • SR-05000022549-1
    • Q15410938
    • (2R,3R)-4-(6-aminopurin-9-yl)-2,3-dihydroxy-butanoic acid
    • (2R,3R)-4-(6-aminopurin-9-yl)-2,3-bis(oxidanyl)butanoic acid
    • 9H-PURINE-9-BUTANOIC ACID, 6-AMINO-.ALPHA.,.BETA.-DIHYDROXY-, (.ALPHA.R,.BETA.R)-
    • 23918-98-1

  • Applications

    Eritadenine is primarily encountered as a natural product isolated from shiitake mushrooms and is mainly used as a biochemical tool and lead compound in enzyme studies, notably as an inhibitor of S-adenosylhomocysteine hydrolase; in research it serves as a reagent for SAH metabolism investigations and as a probe in cellular studies of lipid regulation, with potential nutraceutical relevance due to reported cholesterol-lowering effects in animal models; in industrial contexts it is typically evaluated for inclusion in mushroom-derived extracts and for development of functional ingredients under regulatory constraints; overall, its applications are largely research-oriented rather than as a consumer additive.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 0.25
    methanol 0.69
    isopropanol 0.2
    water 3.84
    ethyl acetate 0.02
    n-propanol 0.39
    acetone 0.03
    n-butanol 0.32
    acetonitrile 0.06
    DMF 4.89
    toluene 0.02
    isobutanol 0.25
    1,4-dioxane 0.11
    methyl acetate 0.05
    THF 0.4
    2-butanone 0.17
    n-pentanol 0.17
    sec-butanol 0.39
    n-hexane 0.02
    ethylene glycol 3.67
    NMP 44.35
    cyclohexane 0.03
    DMSO 8.99
    n-butyl acetate 0.06
    n-octanol 0.05
    chloroform 0.01
    n-propyl acetate 0.03
    acetic acid 1.26
    dichloromethane 0.02
    cyclohexanone 0.53
    propylene glycol 4.98
    isopropyl acetate 0.01
    DMAc 9.95
    2-ethoxyethanol 1.73
    isopentanol 0.23
    n-heptane 0.08
    ethyl formate 0.07
    1,2-dichloroethane 0.02
    n-hexanol 0.25
    2-methoxyethanol 4.9
    isobutyl acetate 0.01
    tetrachloromethane 0.02
    n-pentyl acetate 0.05
    transcutol 0.98
    n-heptanol 0.2
    ethylbenzene 0.02
    MIBK 0.05
    2-propoxyethanol 1.56
    tert-butanol 0.22
    MTBE 0.03
    2-butoxyethanol 0.9
    propionic acid 0.68
    o-xylene 0.04
    formic acid 23.9
    diethyl ether 0.04
    m-xylene 0.02
    p-xylene 0.04
    chlorobenzene 0.01
    dimethyl carbonate 0.09
    n-octane 0.02
    formamide 14.68
    cyclopentanone 0.75
    2-pentanone 0.08
    anisole 0.03
    cyclopentyl methyl ether 0.2
    gamma-butyrolactone 0.89
    1-methoxy-2-propanol 2.27
    pyridine 0.26
    3-pentanone 0.12
    furfural 1.58
    n-dodecane 0.01
    diethylene glycol 4.53
    diisopropyl ether 0.01
    tert-amyl alcohol 0.39
    acetylacetone 0.04
    n-hexadecane 0.01
    acetophenone 0.11
    methyl propionate 0.1
    isopentyl acetate 0.06
    trichloroethylene 0.03
    n-nonanol 0.07
    cyclohexanol 0.54
    benzyl alcohol 0.17
    2-ethylhexanol 0.16
    isooctanol 0.13
    dipropyl ether 0.17
    1,2-dichlorobenzene 0.01
    ethyl lactate 0.33
    propylene carbonate 0.19
    n-methylformamide 2.54
    2-pentanol 0.2
    n-pentane 0.03
    1-propoxy-2-propanol 0.93
    1-methoxy-2-propyl acetate 0.13
    2-(2-methoxypropoxy) propanol 0.7
    mesitylene 0.02
    ε-caprolactone 0.5
    p-cymene 0.05
    epichlorohydrin 0.23
    1,1,1-trichloroethane 0.01
    2-aminoethanol 3.99
    morpholine-4-carbaldehyde 5.34
    sulfolane 8.97
    2,2,4-trimethylpentane 0.01
    2-methyltetrahydrofuran 0.27
    n-hexyl acetate 0.04
    isooctane 0.0
    2-(2-butoxyethoxy)ethanol 0.83
    sec-butyl acetate 0.02
    tert-butyl acetate 0.02
    decalin 0.01
    glycerin 23.79
    diglyme 1.19
    acrylic acid 1.43
    isopropyl myristate 0.02
    n-butyric acid 0.3
    acetyl acetate 0.01
    di(2-ethylhexyl) phthalate 0.07
    ethyl propionate 0.04
    nitromethane 0.72
    1,2-diethoxyethane 0.07
    benzonitrile 0.07
    trioctyl phosphate 0.07
    1-bromopropane 0.02
    gamma-valerolactone 2.12
    n-decanol 0.06
    triethyl phosphate 0.14
    4-methyl-2-pentanol 0.09
    propionitrile 0.09
    vinylene carbonate 0.16
    1,1,2-trichlorotrifluoroethane 3.18
    DMS 0.05
    cumene 0.02
    2-octanol 0.09
    2-hexanone 0.08
    octyl acetate 0.03
    limonene 0.08
    1,2-dimethoxyethane 0.71
    ethyl orthosilicate 0.13
    tributyl phosphate 0.06
    diacetone alcohol 0.42
    N,N-dimethylaniline 0.1
    acrylonitrile 0.18
    aniline 0.13
    1,3-propanediol 2.52
    bromobenzene 0.01
    dibromomethane 0.01
    1,1,2,2-tetrachloroethane 0.05
    2-methyl-cyclohexyl acetate 0.1
    tetrabutyl urea 0.22
    diisobutyl methanol 0.09
    2-phenylethanol 0.16
    styrene 0.01
    dioctyl adipate 0.04
    dimethyl sulfate 0.62
    ethyl butyrate 0.08
    methyl lactate 1.04
    butyl lactate 0.29
    diethyl carbonate 0.06
    propanediol butyl ether 0.85
    triethyl orthoformate 0.16
    p-tert-butyltoluene 0.04
    methyl 4-tert-butylbenzoate 0.2
    morpholine 0.49
    tert-butylamine 0.1
    n-dodecanol 0.04
    dimethoxymethane 0.49
    ethylene carbonate 0.09
    cyrene 2.67
    2-ethoxyethyl acetate 0.07
    2-ethylhexyl acetate 0.06
    1,2,4-trichlorobenzene 0.03
    4-methylpyridine 0.12
    dibutyl ether 0.04
    2,6-dimethyl-4-heptanol 0.09
    DEF 0.52
    dimethyl isosorbide 1.01
    tetrachloroethylene 0.07
    eugenol 0.41
    triacetin 0.08
    span 80 0.53
    1,4-butanediol 1.08
    1,1-dichloroethane 0.01
    2-methyl-1-pentanol 0.15
    methyl formate 0.66
    2-methyl-1-butanol 0.39
    n-decane 0.01
    butyronitrile 0.07
    3,7-dimethyl-1-octanol 0.04
    1-chlorooctane 0.01
    1-chlorotetradecane 0.01
    n-nonane 0.01
    undecane 0.01
    tert-butylcyclohexane 0.01
    cyclooctane 0.02
    cyclopentanol 0.88
    tetrahydropyran 0.12
    tert-amyl methyl ether 0.1
    2,5,8-trioxanonane 1.1
    1-hexene 0.04
    2-isopropoxyethanol 0.48
    2,2,2-trifluoroethanol 1.39
    methyl butyrate 0.09

    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