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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H11NO3.ClH
Molecular Weight 229.66
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Amino-4-oxo-4-phenylbutanoic acid hydrochloride, (2S)-

SMILES

Cl.N[C@@H](CC(=O)C1=CC=CC=C1)C(O)=O

InChI

InChIKey=QSZYKVGEOKNNOP-QRPNPIFTSA-N
InChI=1S/C10H11NO3.ClH/c11-8(10(13)14)6-9(12)7-4-2-1-3-5-7;/h1-5,8H,6,11H2,(H,13,14);1H/t8-;/m0./s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
(2S)-2-Amino-4-oxo-4-phenylbutanoic acid hydrochloride
Preferred Name English
2-Amino-4-oxo-4-phenylbutanoic acid hydrochloride, (2S)-
Systematic Name English
Benzenebutanoic acid, ?-amino-?-oxo-, hydrochloride, (?S)-
Systematic Name English
Benzenebutanoic acid, ?-amino-?-oxo-, hydrochloride, (S)-
Systematic Name English
Benzenebutanoic acid, ?-amino-?-oxo-, hydrochloride (1:1), (?S)-
Systematic Name English
Code System Code Type Description
CAS
168154-76-5
Created by admin on Wed Apr 02 17:48:05 GMT 2025 , Edited by admin on Wed Apr 02 17:48:05 GMT 2025
PRIMARY
FDA UNII
PZ8WPL9SSV
Created by admin on Wed Apr 02 17:48:05 GMT 2025 , Edited by admin on Wed Apr 02 17:48:05 GMT 2025
PRIMARY
PUBCHEM
11160560
Created by admin on Wed Apr 02 17:48:05 GMT 2025 , Edited by admin on Wed Apr 02 17:48:05 GMT 2025
PRIMARY
NIH
NCATS
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