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Levodopa EP Impurity A

CAT: 1299-RM-L041601-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-L041601-02Size:25 mg
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CAS Number
27244-64-0
Synonyms
(2S) -2-Amino-3- (2,4,5-trihydroxyphenyl) propanoic acid
Molecular Formula
C9H11NO5
Molecular Weight
213.19
Target Alternative Name
Levodopa
Product Name Synonym
(2S) -2-Amino-3- (2,4,5-trihydroxyphenyl) propanoic acid

Chemical Information

L-6-Hydroxydopa

6-hydroxy-L-dopa is an L-alpha-amino acid that is L-dopa carrying an additional hydroxy substituent at position 6. It is a non-proteinogenic L-alpha-amino acid and a L-phenylalanine derivative. It is functionally related to a L-dopa.

CAS Number27244-64-0
PubChem CID33755
IUPAC Name(2S)-2-amino-3-(2,4,5-trihydroxyphenyl)propanoic acid
Molecular FormulaC9H11NO5
Molecular Weight213.19
XLogP-2.5
Topological Polar Surface Area124
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count15
Formal Charge0
Complexity235
SMILES
C1=C(C(=CC(=C1O)O)O)C[C@@H](C(=O)O)N
InChI
InChI=1S/C9H11NO5/c10-5(9(14)15)1-4-2-7(12)8(13)3-6(4)11/h2-3,5,11-13H,1,10H2,(H,14,15)/t5-/m0/s1
InChIKey
YLKRUSPZOTYMAT-YFKPBYRVSA-N
Chemical Structure
2D Structure
2D structure of L-6-Hydroxydopa
CAS: 27244-64-0
CID: 33755
Formula: C9H11NO5
MW: 213.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight213.19
XLogP3-2.5
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass213.06372245
Monoisotopic Mass213.06372245
Topological Polar Surface Area124 Ų
Heavy Atom Count15
Formal Charge0
Complexity235
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