4H-1-Benzopyran-4-one, 8-(6-O-acetyl-β-D-glucopyranosyl)-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-β-D-xylopyranosyl-
CAS Registry Number®
163345-99-1
CAS Name
4H-1-Benzopyran-4-one, 8-(6-O-acetyl-β-D-glucopyranosyl)-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-β-D-xylopyranosyl-Molecular Formula
C28H30O15Molecular Mass
606.53Cite this Page
4H-1-Benzopyran-4-one, 8-(6-O-acetyl-β-D-glucopyranosyl)-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-β-D-xylopyranosyl-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=163345-99-1 (retrieved ) (CAS RN: 163345-99-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C28H30O15/c1-9(29)40-8-15-20(34)23(37)25(39)28(43-15)18-22(36)17(27-24(38)19(33)13(32)7-41-27)21(35)16-12(31)6-14(42-26(16)18)10-2-4-11(30)5-3-10/h2-6,13,15,19-20,23-25,27-28,30,32-39H,7-8H2,1H3
InChIKey
InChIKey=AIQCDEJOKQHKMO-UHFFFAOYSA-N
SMILES
OC=1C(=C2C(=C(O)C1C3C(O)C(O)C(O)CO3)C(=O)C=C(O2)C4=CC=C(O)C=C4)C5OC(COC(C)=O)C(O)C(O)C5O
Canonical SMILES
O=C1C=C(OC2=C1C(O)=C(C(O)=C2C3OC(COC(=O)C)C(O)C(O)C3O)C4OCC(O)C(O)C4O)C=5C=CC(O)=CC5
Other Names for this Substance
- 4H-1-Benzopyran-4-one, 8-(6-O-acetyl-β-D-glucopyranosyl)-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-β-D-xylopyranosyl-