COMPUTED DESCRIPTORS
| Molecular Weight | 564.6 g/mol |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 564.23727013 g/mol |
| Monoisotopic Mass | 564.23727013 g/mol |
| Topological Polar Surface Area | 138 Ų |
| Heavy Atom Count | 42 |
| Formal Charge | 0 |
| Complexity | 1080 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Purpurin 18 is a natural product found in Ruditapes philippinarum with data available.