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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H11NO2
Molecular Weight 165.1891
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (S)-3-Amino-3-phenylpropanoic acid

SMILES

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

InChI

InChIKey=UJOYFRCOTPUKAK-QMMMGPOBSA-N
InChI=1S/C9H11NO2/c10-8(6-9(11)12)7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1

HIDE SMILES / InChI

Molecular Formula C9H11NO2
Molecular Weight 165.1891
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:19:08 GMT 2025
Edited
by admin
on Wed Apr 02 17:19:08 GMT 2025
Record UNII
GZ5N3GS3WH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(?S)-?-Aminobenzenepropanoic acid
Preferred Name English
(S)-3-Amino-3-phenylpropanoic acid
Systematic Name English
Benzenepropanoic acid, ?-amino-, (?S)-
Systematic Name English
Code System Code Type Description
CAS
40856-44-8
Created by admin on Wed Apr 02 17:19:08 GMT 2025 , Edited by admin on Wed Apr 02 17:19:08 GMT 2025
PRIMARY
FDA UNII
GZ5N3GS3WH
Created by admin on Wed Apr 02 17:19:08 GMT 2025 , Edited by admin on Wed Apr 02 17:19:08 GMT 2025
PRIMARY
PUBCHEM
686704
Created by admin on Wed Apr 02 17:19:08 GMT 2025 , Edited by admin on Wed Apr 02 17:19:08 GMT 2025
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER
SALT/SOLVATE -> PARENT