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Mercamine ascorbate

CAT: 0013-GTR19223145-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19223145-01Size:100 mg
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Description
Mercamine ascorbate is a bioactive small molecule compound utilized in biochemical research. It serves as a tool in studies investigating antioxidant mechanisms and metal chelation, with applications in both in vitro assays and in vivo experimental models.
CAS Number
16031-82-6
Smiles
[C@@H] (CO) (O) [C@@]1 (C (O) =C (O) C (=O) O1) [H].C (CS) N
Molecular Formula
C8H15NO6S
Molecular Weight
253.27
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Mercamine ascorbate
CAS Number16031-82-6
PubChem CID54676859
IUPAC Name2-aminoethanethiol;2-(1,2-dihydroxyethyl)-3,4-dihydroxy-2H-furan-5-one
Molecular FormulaC8H15NO6S
Molecular Weight253.28
Topological Polar Surface Area134
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Heavy Atom Count16
Formal Charge0
Complexity242
SMILES
C(CS)N.C(C(C1C(=C(C(=O)O1)O)O)O)O
InChI
InChI=1S/C6H8O6.C2H7NS/c7-1-2(8)5-3(9)4(10)6(11)12-5;3-1-2-4/h2,5,7-10H,1H2;4H,1-3H2
InChIKey
NQEDADDMLOPGQH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mercamine ascorbate
CAS: 16031-82-6
CID: 54676859
Formula: C8H15NO6S
MW: 253.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight253.28
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Exact Mass253.06200837
Monoisotopic Mass253.06200837
Topological Polar Surface Area134 Ų
Heavy Atom Count16
Formal Charge0
Complexity242
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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