2-(1,2,3,4-Tetrahydroxybutyl)-4-thiazolidinecarboxylic acid
Basic information
- CAS
17087-36-4- Standard SMILES
O=C(O)C1CSC(C(O)C(O)C(O)CO)N1- InChIKey
AGZXTDUDXXPCMJ-UHFFFAOYSA-N- Molecular formula
- C8H15NO6S
- Average molar mass
- 253.28 g/mol
- Monoisotopic mass
- 253.06200837
Overview
cyclic condensation product of ribose and cysteine; structure given in first source; prodrug of L-cysteine; stimulates glutathione biosynthesis; has protective effect against radiation-induced injury and oxidative stress
Names & identifiers
- Preferred name
- 2-(1,2,3,4-Tetrahydroxybutyl)-4-thiazolidinecarboxylic acid
- IUPAC
- 2-(1,2,3,4-tetrahydroxybutyl)-1,3-thiazolidine-4-carboxylic acid
- English name
- 2-(1,2,3,4-tetrahydroxybutyl)thiazolidine-4-carboxylic acid
- Molecular formula
- C8H15NO6S
- Molecular weight
- 253.27
Names & synonyms
17087-36-42-(1',2',3',4'-Tetrahydroxybutyl)thiazolidine-4-carboxylic acidRefChem:9090232-(1,2,3,4-Tetrahydroxybutyl)-4-thiazolidinecarboxylic acid2-(1,2,3,4-Tetrahydroxybutyl)thiazolidine-4-carboxylic acid2-(1,2,3,4-Tetrahydroxybutyl)-1,3-thiazolidine-4-carboxylic acid59246-17-22-(L-Arabino-tetrahydroxybutyl)-4(R)-1,3-thiazolidine-4-carboxylic acid2-(L-XYLO-TETRAHYDROXYBUTYL)-4(R)-1,3-THIAZOLIDINE-4-CARBOXYLIC ACID110270-19-42-(D-Arabino-tetrahydroxybutyl)-4(R)-1,3-thiazolidine-4-carboxylic acid2-(D-XYLO-TETRAHYDROXYBUTYL)-4-(R)-1,3-THIAZOLIDINE-4-CARBOXYLIC ACID
Show more names
4-Thiazolidinecarboxylicacid, 2-(1,2,3,4-tetrahydroxybutyl)-
AGZXTDUDXXPCMJ-UHFFFAOYSA-NEINECS 241-147-2SCHEMBL5508635DTXSID20937844HJA61715DB-040911NS00054086D-ribo-2-(1',2',3',4'-tetrahydroxybutyl)thiazolidine-4-carboxylic acid
Properties
Computed structural properties
- XLogP
- -4.8
- Topological polar surface area
- 156 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 253
Physicochemical properties
- Boiling point
- 654.4 · 654.4±55.0 °C(Predicted)
- Density
- 1.624 · 1.624±0.06 g/cm3(Predicted)
- pka
- 1.97 · 1.97±0.40(Predicted)
- Cosmetics Ingredients Functions
- ANTIOXIDANT
- FDA UNII
- 4 PS0070ASU · 4PS0070ASU
Chemistry & industry
Applications
DescriptionTetrahydroxybutyl Timonacic is the heterocyclic compound.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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