120444-60-2
Product Name:
2-(3,4-Dihydroxyphenyl)ethyl O-6-deoxy-alpha-L-mannopyranosyl-(1-3)-O-[beta-D-glucopyranosyl-(1-6)]-beta-D-glucopyranoside 4-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoate]
Formula:
C36H48O20
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COMPUTED DESCRIPTORS
| Molecular Weight | 800.8 g/mol |
|---|---|
| XLogP3 | -1.8 |
| Hydrogen Bond Donor Count | 11 |
| Hydrogen Bond Acceptor Count | 20 |
| Rotatable Bond Count | 15 |
| Exact Mass | 800.27389392 g/mol |
| Monoisotopic Mass | 800.27389392 g/mol |
| Topological Polar Surface Area | 313 Ų |
| Heavy Atom Count | 56 |
| Formal Charge | 0 |
| Complexity | 1250 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 15 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Jionoside A1 is a natural product found in Cistanche tubulosa and Cistanche phelypaea with data available.