Compound Summary
Compound Information
1421-65-4
Compound Name: | 1421-65-4 |
Compound CID: | 10131132 |
Synonyms: | 1421-65-4 (S)-Methyl 2-amino-3-(3,4-dihydroxyphenyl)propanoate hydrochloride L-3,4-Dihydroxyphenylalanine methyl ester hydrochloride Melevodopa hydrochloride Methyl L-DOPA hydrochloride More... |
Iupac Name: | methyl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate;hydrochloride |
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 |
Canonical Smiles: | COC(=O)C(CC1=CC(=C(C=C1)O)O)N.Cl |
Isomeric Smiles: | COC(=O)[C@H](CC1=CC(=C(C=C1)O)O)N.Cl |
Molecular Weight: | 247.67 |
Molecular Formula: | C10H14ClNO4 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
1421-65-4
Molecular Weight: | 247.67 |
Molecular Formula: | C10H14ClNO4 |
Hydrogen Bond Donor Count: | 4 |
Hydrogen Bond Acceptor Count: | 5 |
Rotatable Bond Count: | 4 |
Heavy Atom Count: | 16 |
Complexity: | 222 |
Synonyms
1421-65-4
| 1421-65-4 | 1421-65-4 |
|---|---|
1421-65-4 |
(S)-Methyl 2-amino-3-(3,4-dihydroxyphenyl)propanoate hydrochloride |
L-3,4-Dihydroxyphenylalanine methyl ester hydrochloride |
Melevodopa hydrochloride |
Methyl L-DOPA hydrochloride |
L-Dopa methyl ester hydrochloride |
UNII-JFU1A8866V |
L-Tyrosine, 3-hydroxy-, methyl ester, hydrochloride |
levodopa methyl ester hydrochloride |
MFCD00038958 |
JFU1A8866V |
L-Tyrosine, 3-hydroxy-, methyl ester, hydrochloride (1:1) |
Alanine, 3-(3,4-dihydroxyphenyl)-, methyl ester, hydrochloride, l- |
3,4-Dihydroxy-L-phenylalanine Methyl Ester Hydrochloride |
NCGC00093792-01 |
L-3,4-Dihydroxyphenylalanine Methyl Ester HCl |
DSSTox_CID_25763 |
DSSTox_RID_81105 |
DSSTox_GSID_45763 |
methyl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate;hydrochloride |
CAS-1421-65-4 |
L-Dopa Me ester hydrochloride |
ST 41769 |
ST-41769 |
C10H14ClNO4 |
MLS002153271 |
SCHEMBL453411 |
3,4-Dihydroxyphenyl-l-alanine methyl ester hydrochloride |
CHEMBL1255756 |
DTXSID4045763 |
Methyl l-3-(3,4-dihydroxyphenyl)alaninate hydrochloride |
ACT09358 |
Alanine, 3-(3,4-dihydroxyphenyl)-, methyl ester, hydrochloride |
AMY31294 |
Tox21_111221 |
Tox21_500356 |
6937AA |
H-Phe{3,4-(OH)2}-OMe.HCl |
L-DOPA methyl ester (hydrochloride) |
AKOS015912904 |
Tox21_111221_1 |
CCG-221660 |
CS-W012679 |
LP00356 |
NSC 295453 |
NCGC00162132-03 |
NCGC00261041-01 |
AS-10467 |
SMR001230709 |
EU-0100356 |
D 1507 |
I10411 |
SR-01000075804 |
J-007612 |
SR-01000075804-1 |
Q27281493 |
3-(3,4-Dihydroxyphenyl)-L-alanine methyl ester hydrochloride |
L-3,4-Dihydroxyphenylalanine methyl ester hydrochloride, solid |
Methyl (S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate hydrochloride |
Experimental Data
1421-65-4
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 33 | umol/L | 0 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
1421-65-4
Statistics Data
1421-65-4
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 0 | 1 | 1 |
Statistics Data Visualization
1421-65-4
