CAS | 91679-27-5 |
Synonyms | (5E,6S)-4β-(2-Methoxy-2-oxoethyl)-5-(2-hydroxyethylidene)-6α-(β-D-glucopyranosyloxy)-5,6-dihydro-4H-pyran-3-carboxylic acid methyl ester |
IUPAC Name | Methyl (4S,5E,6S)-5-(2-hydroxyethylidene)-4-(2-methoxy-2-oxoethyl)-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate |
Molecular Weight | 434.39 |
Molecular Formula | C18H26O12 |
Canonical SMILES | COC(=O)C[C@@H]\1C(=CO[C@H](/C1=C/CO)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C(=O)OC |
InChI | InChI=1S/C18H26O12/c1-26-12(21)5-9-8(3-4-19)17(28-7-10(9)16(25)27-2)30-18-15(24)14(23)13(22)11(6-20)29-18/h3,7,9,11,13-15,17-20,22-24H,4-6H2,1-2H3/b8-3+/t9-,11+,13+,14-,15+,17-,18-/m0/s1 |
InChI Key | ZJOVYMALVBUVMI-BPOHLUMASA-N |
Purity | 98% |
Appearance | Solid |
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