CHEMICAL AND PHYSICAL PROPERTIES
Chemical Classes | Biological Agents -> Plant Oils and Extracts |
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COMPUTED DESCRIPTORS
Molecular Weight | 1131.3 g/mol |
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XLogP3 | 0.7 |
Hydrogen Bond Donor Count | 13 |
Hydrogen Bond Acceptor Count | 24 |
Rotatable Bond Count | 16 |
Exact Mass | 1130.55090361 g/mol |
Monoisotopic Mass | 1130.55090361 g/mol |
Topological Polar Surface Area | 388 Ų |
Heavy Atom Count | 79 |
Formal Charge | 0 |
Complexity | 2300 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 19 |
Undefined Atom Stereocenter Count | 8 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
beta-Escin is a natural product found in Aesculus hippocastanum with data available.