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Erdosteine

CAT: 1410-M16143-03Size: 500 mgDry Ice: NoHazardous: No
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CAT#:1410-M16143-03Size:500 mg
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Description
Erdosteine is a mucolytic. Erdosteine is a thiol derivative developed for the treatment of chronic obstructive bronchitis, including acute infective exacerbation of chronic bronchitis.
CAS Number
84611-23-4
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
249.3
Molecular Formula
C8H11NO4S2
Notes
Research use only, not for human use.
Receptor
Adenosine deaminase

Chemical Information

Erdosteine

Erdosteine is a N-acyl-amino acid.

CAS Number84611-23-4
PubChem CID65632
IUPAC Name2-[2-oxo-2-[(2-oxothiolan-3-yl)amino]ethyl]sulfanylacetic acid
Molecular FormulaC8H11NO4S2
Molecular Weight249.3
XLogP-0.1
Topological Polar Surface Area134
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count15
Formal Charge0
Complexity282
SMILES
C1CSC(=O)C1NC(=O)CSCC(=O)O
InChI
InChI=1S/C8H11NO4S2/c10-6(3-14-4-7(11)12)9-5-1-2-15-8(5)13/h5H,1-4H2,(H,9,10)(H,11,12)
InChIKey
QGFORSXNKQLDNO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Erdosteine
CAS: 84611-23-4
CID: 65632
Formula: C8H11NO4S2
MW: 249.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight249.3
XLogP3-0.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass249.01295018
Monoisotopic Mass249.01295018
Topological Polar Surface Area134 Ų
Heavy Atom Count15
Formal Charge0
Complexity282
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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