92631-87-3
Product Name:
Methanone, [3-[2,6-bis-O-(3,4,5-trihydroxybenzoyl)-β-D-glucopyranosyl]-2,4,6-trihydroxyphenyl](4-hydroxyphenyl)-
Formula:
C33H28O18
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COMPUTED DESCRIPTORS
| Molecular Weight | 712.6 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 12 |
| Hydrogen Bond Acceptor Count | 18 |
| Rotatable Bond Count | 10 |
| Exact Mass | 712.12756404 g/mol |
| Monoisotopic Mass | 712.12756404 g/mol |
| Topological Polar Surface Area | 322 Ų |
| Heavy Atom Count | 51 |
| Formal Charge | 0 |
| Complexity | 1190 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 5 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |