CHEMICAL AND PHYSICAL PROPERTIES
| Collision Cross Section | 128.7 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)] |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 141.17 g/mol |
|---|---|
| XLogP3 | -1.2 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 141.090211983 g/mol |
| Monoisotopic Mass | 141.090211983 g/mol |
| Topological Polar Surface Area | 74.9 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 99 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Histidinol is a natural product found in Glycine max and Phaseolus vulgaris with data available.