38254-15-8
Product Name:
(17S,22R)-5,6β-Epoxy-14,17,20,22-tetrahydroxy-1-oxo-5β-ergosta-2,24-dien-26-oic acid δ-lactone
Formula:
C28H38O7
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 486.6 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 2 |
| Exact Mass | 486.26175355 g/mol |
| Monoisotopic Mass | 486.26175355 g/mol |
| Topological Polar Surface Area | 117 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 1090 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 10 |
| 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
Withanolide E is a natural product found in Physalis peruviana and Withania somnifera with data available.