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Carbocisteine

CAT: 0572-TRC-C178760-25GSize: 25 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-C178760-25GSize:25 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
638-23-3
Synonyms
Carbocisteine; Alanine, 3-[(carboxymethyl)thio]-, L- (6CI,8CI); (L)-2-Amino-3-(carboxymethylthio)propionic acid; (R)-S-(Carboxymethyl)cysteine; 3-[(Carboxymethyl)thio]-L-alanine; AHR 3053; Bronchokod; Carbocit; Carbocysteine; Chilvax; DF 1794Y; L-(Carboxymethyl)cysteine; LJ 206; Lisil; Lisomucil; Loviscol; Muciclar; Mucocis; Mucodyne; Mucofan; Mucolase; Mucolex; Mucopront; Mucotab; Mukinyl; NSC 14156; Pectox; Pulmoclase; Reomucil; Rhinathiol; Rhinatiol; Rinatiol; S-(Carboxymethyl)-(R)-cysteine; S-(Carboxymethyl)-L-cysteine; S-Carboxylmethyl-L-cysteine; Siroxyl; Thiodril; Transbronchin
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
N[C@@H](CSCC(=O)O)C(=O)O
Molecular Formula
C5 H9 N O4 S
Molecular Weight
179.19
InChI
InChI=1S/C5H9NO4S/c6-3(5(9)10)1-11-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1
Additionnal Information
IUPAC name: (2R)-2-amino-3-(carboxymethylsulfanyl)propanoic acid
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Carbocysteine

S-carboxymethyl-L-cysteine is an L-cysteine thioether that is L-cysteine in which the hydrogen of the thiol group has been replaced by a carboxymethyl group. It has a role as a mucolytic. It is a L-cysteine thioether and a non-proteinogenic L-alpha-amino acid. It is a conjugate acid of a S-carboxylatomethyl-L-cysteine(1-).

CAS Number638-23-3
PubChem CID193653
IUPAC Name(2R)-2-amino-3-(carboxymethylsulfanyl)propanoic acid
Molecular FormulaC5H9NO4S
Molecular Weight179.20
XLogP-3.1
Topological Polar Surface Area126
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count11
Formal Charge0
Complexity161
SMILES
C([C@@H](C(=O)O)N)SCC(=O)O
InChI
InChI=1S/C5H9NO4S/c6-3(5(9)10)1-11-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1
InChIKey
GBFLZEXEOZUWRN-VKHMYHEASA-N
Chemical Structure
2D Structure
2D structure of Carbocysteine
CAS: 638-23-3
CID: 193653
Formula: C5H9NO4S
MW: 179.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight179.20
XLogP3-3.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass179.02522894
Monoisotopic Mass179.02522894
Topological Polar Surface Area126 Ų
Heavy Atom Count11
Formal Charge0
Complexity161
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-D0205A-01Carbocisteine
CS-O-06463Carbocisteine-13C3
HY-D0205AR-01Carbocisteine (Standard)
T13440-01(RS) -Carbocisteine
RM-C020301-01Carbocisteine Impurity A
HY-D0205AS2Carbocisteine-d3
MBS6047802-01Carbocisteine Lactam
MBS5754189(RS)-Carbocisteine
HY-D0205AS1Carbocisteine-13C3-1
RM-C010228-01Carbocisteine Impurity 28

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