471-71-6
Product Name:
(4bα,8aβ,10aα)-7-[(E)-2-[2-(Dimethylamino)ethoxy]-2-oxoethylidene]tetradecahydro-1α,4aβ,8α-trimethyl-9-oxo-1β-phenanthrenecarboxylic acid methyl ester
Formula:
C25H39NO5
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 433.6 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 433.28282334 g/mol |
| Monoisotopic Mass | 433.28282334 g/mol |
| Topological Polar Surface Area | 72.9 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 759 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 6 |
| 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
Cassamine is a natural product found in Erythrophleum guineense and Erythrophleum suaveolens with data available.