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DL-Cysteic acid

HCID 178917367
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
3024-83-7
Standard SMILES
NC(CS(=O)(=O)O)C(=O)O
InChIKey
XVOYSCVBGLVSOL-UHFFFAOYSA-N
Molecular formula
C3H7NO5S
Average molar mass
169.16 g/mol

Overview

Cysteic acid is an amino sulfonic acid that is the sulfonic acid analogue of cysteine. It has a role as an animal metabolite. It is an alanine derivative, a cysteine derivative, an amino sulfonic acid, a carboxyalkanesulfonic acid and a non-proteinogenic alpha-amino acid.

Names & identifiers

Preferred name
DL-Cysteic acid
IUPAC
2-amino-3-sulfopropanoic acid
English name
DL-Cysteic acid
Molecular formula
C3H7NO5S
Molecular weight
169.16

Names & synonyms

13100-82-8DL-CYSTEIC ACIDCysteic AcidcysteateAlanine, 3-sulfo-beta-SulfoalanineA3OGP4C37WCYSTEIC ACID, DL-CHEBI:212603 Sulfoalaninebeta SulfoalanineAcid, Cysteic
Show more names
DL-Cystetic AcidDL-CYSTEIC ACID USP/EP/BP
RefChem:9205462-amino-3-sulfopropanoic acid3-Sulfoalanine3024-83-7Cysteinic acidCepteic acidCipteic acidCysteric acid

Database identifiers

CAS
3024-83-7
ChEMBL
CHEMBL1171434
ChEBI
CHEBI:21260
UNII
A3OGP4C37W
EC Number
829-938-6
Nikkaji
J8.084E

Properties

Computed structural properties

XLogP
-4.5
Topological polar surface area
126 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
10
Formal charge
0
Complexity
214

Experimental & physicochemical properties

Chemical ClassesOther Uses -> Biochemical Research
Physical Description · 2 items

Solid; [Merck Index]

Solid

Collision Cross Section131.4 Ų [M+Na-2H]- [CCS Type: DT; Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]

Physicochemical properties

Melting point
273 °C · 273°C (rough estimate)
Density
1.433 · 1.433 (estimate)
refractive index
1.513 · 1.5130 (estimate)
form
solid
pka
1.3 · 1.3, 1.9, 8.70(at 25℃)

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Chemistry & industry

Pharmacology

Cellular LocationsMitochondria
Metabolite PathwaysTaurine and Hypotaurine Metabolism

Uses & manufacturing

UsesAn amino acid with a C-terminal sulfonic acid group which has been isolated from human hair oxidized with permanganate. It occurs normally in the outer part of the sheep's fleece, where the wool is exposed to light and weather. [ChemIDplus]

Suppliers5 total

career henan chemical co+86-0371-86658258 · [email protected]
江苏洪珉药业有限公司18221292452 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Additional notes · 1 item

DefinitionChEBI: Cysteic acid is an amino sulfonic acid that is the sulfonic acid analogue of cysteine. It has a role as an animal metabolite. It is an alanine derivative, an amino sulfonic acid, a carboxyalkanesulfonic acid, a cysteine derivative and a non-proteinogenic alpha-amino acid.

Related reactions

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Compound notes

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