Cas no 29884-49-9 (Astringin)

Astringin structure
Astringin structure
Product Name:Astringin
CAS No:29884-49-9
MF:C20H22O9
MW:406.383286952972
MDL:MFCD03427331
CID:266992
PubChem ID:5281712
Update Time:2025-04-19

Astringin Chemical and Physical Properties

Names and Identifiers

    • b-D-Glucopyranoside,3-[(1E)-2-(3,4-dihydroxyphenyl)ethenyl]-5-hydroxyphenyl
    • Trans-Astringin
    • (2S,3R,4S,5S,6R)-2-[3-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-5-hydroxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
    • Astringin(Piceatannol-3'-O-β-D-glucopyranoside)
    • (E)-Astringin
    • Astringin
    • 3,4,3',5'-Tetrahydroxystilbene 3'-glucoside
    • E-3,4,5'-Trihydroxy-3'-glucopyranosylstilbene
    • E-Astringin
    • piceatannol 3-beta-glucoside
    • (Z)-Piceatannol 3-glucoside
    • piceatannol 3-beta-D-glucoside
    • piceatannol 3-O-beta-D-glucoside
    • LMPK13090007
    • C10245
    • Q4811458
    • beta-D-Glucopyranoside, 3-(2-(3,4-dihydroxyphenyl)ethenyl)-5-hydroxyphenyl, (E)-
    • 3-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-5-hydro
    • .BETA.-D-GLUCOPYRANOSIDE, 3-((1E)-2-(3,4-DIHYDROXYPHENYL)ETHENYL)-5-HYDROXYPHENYL
    • (2S,3R,4S,5S,6R)-2-(3-((E)-2-(3,4-DIHYDROXYPHENYL)ETHENYL)-5-HYDROXYPHENOXY)-6-(HYDROXYMETHYL)OXANE-3,4,5-TRIOL
    • CHEMBL358769
    • HY-N4093
    • 3-[(E)-2-(3,4-Dihydroxyphenyl)vinyl]-5-hydroxyphenyl beta-D-glucopyranoside
    • MS-26957
    • CS-0032099
    • (2s,3r,4s,5s,6r)-2-[3-[(e)-2-(3,4-dihydroxyphenyl)ethenyl]-5-hydroxyphenoxy]-6-(hydroxymethyl) oxane-3,4,5-triol
    • 3-((1E)-2-(3,4-DIHYDROXYPHENYL)ETHENYL)-5-HYDROXYPHENYL .BETA.-D-GLUCOPYRANOSIDE
    • SCHEMBL501245
    • 3-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-5-hydroxyphenyl beta-D-glucopyranoside
    • AKOS040760281
    • 29884-49-9
    • (2S,3R,4S,5S,6R)-2-(3-((E)-3,4-dihydroxystyryl)-5-hydroxyphenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
    • DTXSID401029689
    • UNII-4ER6YKM4YL
    • CHEBI:2899
    • 4ER6YKM4YL
    • (2S,3R,4S,5S,6R)-2-[3-[(E)-2-(3,4-dihydroxyphenyl)vinyl]-5-hydroxy-phenoxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
    • MFCD03427331
    • 3,3',4,5'-Tetrahydroxystilbene 3'-glucoside
    • DA-59574
    • MDL： MFCD03427331
    • Inchi： 1S/C20H22O9/c21-9-16-17(25)18(26)19(27)20(29-16)28-13-6-11(5-12(22)8-13)2-1-10-3-4-14(23)15(24)7-10/h1-8,16-27H,9H2/b2-1+/t16-,17-,18+,19-,20-/m1/s1
    • InChI Key： PERPNFLGJXUDDW-CUYWLFDKSA-N
    • SMILES： O1[C@H]([C@@H]([C@H]([C@@H]([C@H]1CO)O)O)O)OC1C=C(C=C(/C=C/C2C=CC(=C(C=2)O)O)C=1)O

Computed Properties

  • Exact Mass: 406.12600
  • Monoisotopic Mass: 406.12638228 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 7
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 29
  • Rotatable Bond Count: 5
  • Complexity: 544
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 5
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.7
  • Topological Polar Surface Area: 160
  • Molecular Weight: 406.4

Experimental Properties

  • Color/Form: Powder
  • Density: 1.593±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 218-220 oC
  • Boiling Point: 756.1°Cat760mmHg
  • Flash Point: 411.1°C
  • Refractive Index: 1.76
  • Solubility: Slightly soluble (3.3 g/l) (25 o C),
  • PSA: 160.07000
  • LogP: 0.15250

Astringin Security Information

  • Signal Word：Warning
  • Storage Condition：Dry, dark and store at 0-4℃ for short term (days to weeks) or -20℃ for long term (Store correctly 2-3years).

Astringin Pricemore >>

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