CHEMICAL AND PHYSICAL PROPERTIES
| Kovats Retention Index | 1423 1384 1384 |
|---|---|
| Chemical Classes | other linear non-peptide |
COMPUTED DESCRIPTORS
| Molecular Weight | 182.30 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Exact Mass | 182.167065321 g/mol |
| Monoisotopic Mass | 182.167065321 g/mol |
| Topological Polar Surface Area | 20.2 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 201 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| 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
(-)-geosmin is the (-)-stereoisomer of geosmin, having 4S,4aS,8aR configuration. It is an enantiomer of a (+)-geosmin.