758718-51-3
Product Name:
(2α,3β)- 2-(Acetyloxy)-3-hydroxy- olean-12-en-28-oic acid
Formula:
C32H50O5
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 514.7 g/mol |
|---|---|
| XLogP3 | 7.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 514.36582469 g/mol |
| Monoisotopic Mass | 514.36582469 g/mol |
| Topological Polar Surface Area | 83.8 Ų |
| Heavy Atom Count | 37 |
| Formal Charge | 0 |
| Complexity | 1030 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 9 |
| 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
(2alpha,3beta)-2-(Acetyloxy)-3-hydroxy-olean-12-en-28-oic acid is a natural product found in Lawsonia inermis and Nothofagus dombeyi with data available.