gentisate 5-O-β-D-xylopyranoside

gentisate 5-<i>O</i>-β-<i>D</i>-xylopyranoside




Chemical Formula:
C12H13O8
Molecular Weight:
285.23 Daltons
Monoisotopic Mass:
286.0688674262 Daltons
SMILES:
C2(OC(OC1(C=CC(O)=C(C(=O)[O-])C=1))C(O)C(O)C(O)2)
InChI:
1S/C12H14O8/c13-7-2-1-5(3-6(7)11(17)18)20-12-10(16)9(15)8(14)4-19-12/h1-3,8-10,12-16H,4H2,(H,17,18)/p-1/t8-,9+,10-,12-/m1/s1
InChIKey:
OGFQCMFLQIYVSQ-DTHBNOIPSA-M

Synonyms
  • gentisic acid 5-O-β-D-xylopyranoside

Databases
MetaCyc:  CPD-19191
PubChem (CID):  122706486
MetaNetX:  MNXM525844