CHEMICAL AND PHYSICAL PROPERTIES
| Collision Cross Section | 197.96 Ų [M+H]+ 196.49 Ų [M+Na]+ 204.79 Ų [M-H]- |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 455.5 g/mol |
|---|---|
| XLogP3 | -1.4 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 8 |
| Exact Mass | 455.05694025 g/mol |
| Monoisotopic Mass | 455.05694025 g/mol |
| Topological Polar Surface Area | 227 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 833 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| 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
(6R,7R)-3-(acetyloxymethyl)-7-[[2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid is a cephalosporin.