24425-56-7
Product Name:
S-HEXYLGLUTATHIONE
Formula:
C16H29N3O6S
Synonyms:
S-Hexyl-L -glutathione reduced
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Collision Cross Section | 203.2 Ų [M+H]+ [CCS Type: DT, Method: stepped-field] |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 391.5 g/mol |
|---|---|
| XLogP3 | -1.8 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 15 |
| Exact Mass | 391.17770683 g/mol |
| Monoisotopic Mass | 391.17770683 g/mol |
| Topological Polar Surface Area | 184 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 475 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| 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
S-hexylglutathione is an S-substituted glutathione that is glutathione in which the hydrogen of the thiol has been replaced by a hexyl group (PDB entry: 1PN9).