| 2D Structure | |
| CID | 485187 |
| Target | / |
| IUPAC Name | (2R,3R,4S,5S,6R)-2-[3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol |
| InChI | InChI=1S/C25H28O10/c1-30-19-8-13(3-2-6-31-25-23(29)22(28)21(27)20(11-26)35-25)7-15-10-17(34-24(15)19)14-4-5-16-18(9-14)33-12-32-16/h4-5,7-10,20-23,25-29H,2-3,6,11-12H2,1H3/t20-,21-,22+,23-,25-/m1/s1 |
| InChI Key | RAMYDZNQLYKTGB-MXCHMSEPSA-N |
| Canonical SMILES | COC1=CC(=CC2=C1OC(=C2)C3=CC4=C(C=C3)OCO4)CCCOC5C(C(C(C(O5)CO)O)O)O |
| Isomeric SMILES | COC1=CC(=CC2=C1OC(=C2)C3=CC4=C(C=C3)OCO4)CCCO[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O |
| Molecular Formula | C25H28O10 |
| Molecular Weight | 488.5 |
| synonyms | ['egonol glucoside', '(2R,3R,4S,5S,6R)-2-[3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol', '77690-83-6', 'egonol beta-glucoside', 'egonol beta-D-glucoside', 'egonol beta-D-glucopyranoside', 'CHEMBL470983', 'CHEBI:134480', 'DTXSID101136055', '3-[2-(1,3-Benzodioxol-5-yl)-7-methoxy-5-benzofuranyl]propyl I(2)-D-glucopyranoside', '3-[2-(2H-1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propyl beta-D-glucopyranoside', '(2R,3R,4S,5S,6R)-2-[3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-benzofuran-5-yl]propoxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol', "5-[3''-(.beta.-D-glucopyranosyloxy)propyl]-7-methoxy-2-(3',4'-methylenedioxyphenyl)benzofuran"] |
From Pubchem