2',3,4,4',6'-pentahydroxychalcone 4'-O-β-D-glucoside

Chemical Formula:

C₂₁H₂₂O₁₁

Molecular Weight:

450.398 Daltons

Monoisotopic Mass:

450.11621154930003 Daltons

SMILES:

C3(OC1(=CC(O)=C(C(O)=C1)C(=O)C=CC2(C=CC(O)=C(O)C=2)))(OC(CO)C(O)C(O)C(O)3)

InChI:

1S/C21H22O11/c22-8-16-18(28)19(29)20(30)21(32-16)31-10-6-14(26)17(15(27)7-10)12(24)4-2-9-1-3-11(23)13(25)5-9/h1-7,16,18-23,25-30H,8H2/b4-2+/t16-,18-,19+,20-,21-/m1/s1

InChIKey:

GZTXEEPKLNRIEL-LYXDKPSQSA-N

Databases

MetaCyc: CPD-8633

PubChem (CID): 23724745

ChEBI: 66904

KEGG: C16408

Seed: cpd15114

MetaNetX: MNXM4767