4-O-β-D-glucosyl-4-hydroxycinnamate

Chemical Formula:

C₁₅H₁₇O₈

Molecular Weight:

325.294 Daltons

Monoisotopic Mass:

326.1001675546 Daltons

SMILES:

C(O)C1(C(O)C(O)C(O)C(O1)OC2(=CC=C(C=CC([O-])=O)C=C2))

InChI:

1S/C15H18O8/c16-7-10-12(19)13(20)14(21)15(23-10)22-9-4-1-8(2-5-9)3-6-11(17)18/h1-6,10,12-16,19-21H,7H2,(H,17,18)/p-1/b6-3+/t10-,12-,13+,14-,15-/m1/s1

InChIKey:

LJFYQZQUAULRDF-FDGSXQGBSA-M

Databases

MetaCyc: CPD-457

ChEBI: 47893

PubChem (CID): 17756753

KEGG: C04415

Seed: cpd02694

MetaNetX: MNXM4372