| 2D Structure | |
| CID | 439514 |
| IUPAC Name | 6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one |
| InChI | InChI=1S/C16H18O9/c1-22-9-4-7-2-3-12(18)23-8(7)5-10(9)24-16-15(21)14(20)13(19)11(6-17)25-16/h2-5,11,13-17,19-21H,6H2,1H3/t11-,13-,14+,15-,16-/m1/s1 |
| InChI Key | SGTCGCCQZOUMJJ-YMILTQATSA-N |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C16H18O9 |
| Molecular Weight | 354.31 |
| synonyms | ['Scopolin', '531-44-2', 'Scopoloside', 'Scopoletin 7-glucoside', 'DTXSID20967621', '1Y49270PY8', 'CHEBI:16065', 'NSC-404560', '6-methoxy-2-oxo-2H-chromen-7-yl beta-D-glucopyranoside', '2H-1-Benzopyran-2-one, 7-(beta-D-glucopyranosyloxy)-6-methoxy-', '6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one', '6-methoxy-7-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxychromen-2-one', 'RefChem:49047', 'DTXCID801764471', 'Murrayin', 'Scopoletin 7-O-Glucoside', '7beta-D-Glucopyranosyloxy-6-methoxycumarin', 'CHEMBL225024', 'MFCD02259444', 'UNII-1Y49270PY8', 'scopoletin-glucoside', 'Scopolin (Standard)', 'NSC 404560', 'SCOPOLIN [MI]', '2H-1-Benzopyran-2-one, 7-(.beta.-D-glucopyranosyloxy)-6-methoxy-', 'orb1303604', 'SCHEMBL1674804', 'HY-N0341R', 'scopoletin-7-O-beta-D-glucoside', 'WLZ4750', 'HY-N0341', 'BDBM50428428', 'MSK159035', 's3262', 'AKOS032962035', 'EBC-470062', 'FS65518', '6-methoxy-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-one', 'AC-34148', 'DA-67495', 'MS-25509', '7-O-.BETA.-GLUCOPYRANOSYLSCOPOLETIN', 'SCOPOLETIN 7-O-beta-D-GLUCOPYRANOSIDE', 'CS-0008900', 'C01527', 'SCOPOLETIN 7-O-.BETA.-D-GLUCOPYRANOSIDE', '6-METHOXYCOUMARIN 7-O-.BETA.-D-GLUCOSIDE', 'Q15426984', '6-METHOXY-7-(.BETA.-D-GLUCOPYRANOSYLOXY)COUMARIN', '7-(.BETA.-D-GLUCOPYRANOSYLOXY)-6-METHOXYCOUMARIN', '6-Methoxy-2-oxo-2H-1-benzopyran-7-yl beta-D-glucopyranoside', '6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-2-one'] |
From Pubchem