Ethanone, 1-[4-[[2-O-[5-O-(4-hydroxy-3,5-dimethoxybenzoyl)-D-apio-β-D-furanosyl]-β-D-glucopyranosyl]oxy]phenyl]-
CAS Registry Number®
228405-06-9
CAS Name
Ethanone, 1-[4-[[2-O-[5-O-(4-hydroxy-3,5-dimethoxybenzoyl)-D-apio-β-D-furanosyl]-β-D-glucopyranosyl]oxy]phenyl]-Molecular Formula
C28H34O15Molecular Mass
610.56Cite this Page
Ethanone, 1-[4-[[2-O-[5-O-(4-hydroxy-3,5-dimethoxybenzoyl)-D-apio-β-D-furanosyl]-β-D-glucopyranosyl]oxy]phenyl]-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=228405-06-9 (retrieved ) (CAS RN: 228405-06-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C28H34O15/c1-13(30)14-4-6-16(7-5-14)41-26-23(22(33)21(32)19(10-29)42-26)43-27-24(34)28(36,12-40-27)11-39-25(35)15-8-17(37-2)20(31)18(9-15)38-3/h4-9,19,21-24,26-27,29,31-34,36H,10-12H2,1-3H3/t19-,21-,22+,23-,24+,26-,27+,28-/m1/s1
InChIKey
InChIKey=DPDBFIMFRJQAKL-SBYRWZHCSA-N
SMILES
O([C@H]1[C@H](O[C@H]2[C@H](O)[C@](COC(=O)C3=CC(OC)=C(O)C(OC)=C3)(O)CO2)[C@@H](O)[C@H](O)[C@@H](CO)O1)C4=CC=C(C(C)=O)C=C4
Canonical SMILES
O=C(OCC1(O)COC(OC2C(OC3=CC=C(C=C3)C(=O)C)OC(CO)C(O)C2O)C1O)C4=CC(OC)=C(O)C(OC)=C4
Other Names for this Substance
- Ethanone, 1-[4-[[2-O-[5-O-(4-hydroxy-3,5-dimethoxybenzoyl)-D-apio-β-D-furanosyl]-β-D-glucopyranosyl]oxy]phenyl]-