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L-DOPA methyl ester (hydrochloride)

CAT: 0931-T7654-01Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0931-T7654-01Size:1 mL - 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1421-65-4
Target
Dopamine Receptor
Related Pathways
Neuroscience, GPCR/G Protein
Purity
0.9994
Bioactivity
L-DOPA methyl ester (LDME) is an agonist of dopamine D1 receptor.
Smiles
Cl.COC(=O)[C@@H](N)Cc1ccc(O)c(O)c1
Molecular Formula
C10H14ClNO4
Molecular Weight
247.675
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Melevodopa hydrochloride

Melevodopa hydrochloride is an organic molecular entity.

CAS Number1421-65-4
PubChem CID10131132
IUPAC Namemethyl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate;hydrochloride
Molecular FormulaC10H14ClNO4
Molecular Weight247.67
Topological Polar Surface Area92.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count16
Formal Charge0
Complexity221
SMILES
COC(=O)[C@H](CC1=CC(=C(C=C1)O)O)N.Cl
InChI
InChI=1S/C10H13NO4.ClH/c1-15-10(14)7(11)4-6-2-3-8(12)9(13)5-6;/h2-3,5,7,12-13H,4,11H2,1H3;1H/t7-;/m0./s1
InChIKey
WFGNJLMSYIJWII-FJXQXJEOSA-N
Chemical Structure
2D Structure
2D structure of Melevodopa hydrochloride
CAS: 1421-65-4
CID: 10131132
Formula: C10H14ClNO4
MW: 247.67
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight247.67
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass247.0611356
Monoisotopic Mass247.0611356
Topological Polar Surface Area92.8 Ų
Heavy Atom Count16
Formal Charge0
Complexity221
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes