Teucardoside
7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-1,7a-dihydrocyclopenta[c]pyran-5-one
Also Known As: teucardosid|TEUCARDOSIDE|7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-1,7a-dihydrocyclopenta[c]pyran-5-one|1-(Hexopyranosyloxy)-7-methyl-5-oxo-5,7a-dihydrocyclopenta[c]pyran-4a(1H)-yl 6-deoxyhexopyranoside
| Molecular Formula | C21H30O13 |
|---|---|
| Molecular Weight | 490.16864 g/mol |
| LogP | -3.4 |
| Topological Polar Surface Area | 205.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 5 |
| Exact Mass | 490.16864 |
| Monoisotopic Mass | 490.16864 |
| Heavy Atoms | 34 |
| Complexity | 831.0 |
Chemical Identifiers
| CAS Number | 78280-92-9 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OC23C=COC(C2C(=CC3=O)C)OC4C(C(C(C(O4)CO)O)O)O)O)O)O |
| InChIKey | WDMQLCVSWBENIY-UHFFFAOYSA-N |
Product Overview
Teucardoside (CAS 78280-92-9), with molecular formula C21H30O13 and molecular weight 490.16864 g/mol. IUPAC: 7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-1,7a-dihydrocyclopenta[c]pyran-5-one.
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