Substance
  • Substance Name: gastrodin
  • Formula: C13H18O7
  • Molecular Weight: 286.28 g/mol
  • Identifiers:
    • inchi: InChI=1S/C13H18O7/c14-5-7-1-3-8(4-2-7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-4,9-18H,5-6H2/t9-,10-,11+,12-,13-/m1/s1
    • inchikey: PUQSUZTXKPLAPR-UJPOAAIJSA-N
    • casrn: 62499-27-8
    • csmiles: C1=CC(=CC=C1CO)OC2C(C(C(C(O2)CO)O)O)O
    • ismiles: C1=CC(=CC=C1CO)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O
    • pubchemId: 115067
    • iupacname: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-(hydroxymethyl)phenoxy]oxane-3,4,5-triol
    • wikidataId: Q5526833
    • chemspiderId: 102977
    • dsstoxcmpId: DTXCID301405414
    • chemblId: CHEMBL274739
    • ecnumber: 683-202-7
gastrodin
Systems and Datasets