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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H14NO5.K
Molecular Weight 303.3523
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of POTASSIUM D-(1-ETHOXYCARBONYLPROPEN-2-YL)-.ALPHA.-AMINO-P-HYDROXYPHENYLACETATE

SMILES

[K+].COC(=O)\C=C(\C)N[C@@H](C([O-])=O)C1=CC=C(O)C=C1

InChI

InChIKey=HFDVONAPNRXRSV-HAPRMPPKSA-M
InChI=1S/C13H15NO5.K/c1-8(7-11(16)19-2)14-12(13(17)18)9-3-5-10(15)6-4-9;/h3-7,12,14-15H,1-2H3,(H,17,18);/q;+1/p-1/b8-7-;/t12-;/m1./s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
POTASSIUM D-(1-ETHOXYCARBONYLPROPEN-2-YL)-.ALPHA.-AMINO-P-HYDROXYPHENYLACETATE
Common Name English
D(-) ALPHA PARAHYDROXY PHENYLGLYCINE DANE SALT METHYL POTASSIUM
Preferred Name English
BENZENEACETIC ACID, 4-HYDROXY-.ALPHA.-((3-METHOXY-1-METHYL-3-OXO-1-PROPEN-1-YL)AMINO)-, POTASSIUM SALT (1:1), (.ALPHA.R)-
Systematic Name English
BENZENEACETIC ACID, 4-HYDROXY-.ALPHA.-(((1Z)-3-METHOXY-1-METHYL-3-OXO-1-PROPEN-1-YL)AMINO)-, POTASSIUM SALT (1:1), (.ALPHA.R)-
Systematic Name English
D-(-)-PARA-HYDROXY PHENYL GLYCINE METHYL POTASSIUM DANE SALT
Common Name English
POTASSIUM N-(1-METHOXYCARBONYL-1-PROPEN-2-YL)-.ALPHA.-AMINO-P-HYDROXYPHENYLACETATE
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
272-168-5
Created by admin on Mon Mar 31 21:33:25 GMT 2025 , Edited by admin on Mon Mar 31 21:33:25 GMT 2025
PRIMARY
PUBCHEM
23716433
Created by admin on Mon Mar 31 21:33:25 GMT 2025 , Edited by admin on Mon Mar 31 21:33:25 GMT 2025
PRIMARY
EPA CompTox
DTXSID30218898
Created by admin on Mon Mar 31 21:33:25 GMT 2025 , Edited by admin on Mon Mar 31 21:33:25 GMT 2025
PRIMARY
CAS
68779-00-0
Created by admin on Mon Mar 31 21:33:25 GMT 2025 , Edited by admin on Mon Mar 31 21:33:25 GMT 2025
PRIMARY
FDA UNII
31VSE1BGDA
Created by admin on Mon Mar 31 21:33:25 GMT 2025 , Edited by admin on Mon Mar 31 21:33:25 GMT 2025
PRIMARY
CAS
69416-61-1
Created by admin on Mon Mar 31 21:33:25 GMT 2025 , Edited by admin on Mon Mar 31 21:33:25 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
ECHA (EC/EINECS)
273-992-8
Created by admin on Mon Mar 31 21:33:25 GMT 2025 , Edited by admin on Mon Mar 31 21:33:25 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
NIH
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