1-Benzopyrylium, 3-[[6-O-[6-deoxy-4-O-[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]-α-L-mannopyranosyl]-β-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5-(β-D-glucopyranosyloxy)-7-hydroxy-, chloride (1:1)
CAS Registry Number®
CAS Name
1-Benzopyrylium, 3-[[6-O-[6-deoxy-4-O-[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]-α-L-mannopyranosyl]-β-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5-(β-D-glucopyranosyloxy)-7-hydroxy-, chloride (1:1)Molecular Formula
C42H47O23.ClCite this Page
1-Benzopyrylium, 3-[[6-O-[6-deoxy-4-O-[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]-α-L-mannopyranosyl]-β-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5-(β-D-glucopyranosyloxy)-7-hydroxy-, chloride (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=62024-15-1 (retrieved ) (CAS RN: 62024-15-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C42H46O23.ClH/c1-15-38(65-29(49)7-3-16-2-5-20(45)22(47)8-16)34(54)37(57)40(59-15)58-14-28-31(51)33(53)36(56)42(64-28)62-26-12-19-24(60-39(26)17-4-6-21(46)23(48)9-17)10-18(44)11-25(19)61-41-35(55)32(52)30(50)27(13-43)63-41;/h2-12,15,27-28,30-38,40-43,50-57H,13-14H2,1H3,(H4-,44,45,46,47,48,49);1H
InChIKey
InChIKey=SUCMKAWIEKBUMA-UHFFFAOYSA-N
SMILES
O(C=1C2=C([O+]=C(C(OC3OC(COC4C(O)C(O)C(OC(C=CC5=CC(O)=C(O)C=C5)=O)C(C)O4)C(O)C(O)C3O)=C2)C6=CC(O)=C(O)C=C6)C=C(O)C1)C7OC(CO)C(O)C(O)C7O.[Cl-]
Canonical SMILES
[Cl-].O=C(OC1C(O)C(O)C(OCC2OC(OC3=CC=4C(OC5OC(CO)C(O)C(O)C5O)=CC(O)=CC4[O+]=C3C=6C=CC(O)=C(O)C6)C(O)C(O)C2O)OC1C)C=CC7=CC=C(O)C(O)=C7
Other Names for this Substance
- 1-Benzopyrylium, 3-[[6-O-[6-deoxy-4-O-[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]-α-L-mannopyranosyl]-β-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5-(β-D-glucopyranosyloxy)-7-hydroxy-, chloride (1:1)
- 1-Benzopyrylium, 3-[[6-O-[6-deoxy-4-O-[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]-α-L-mannopyranosyl]-β-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5-(β-D-glucopyranosyloxy)-7-hydroxy-, chloride