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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H17NO4
Molecular Weight 299.3212
Optical Activity ( - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl (2R,3S)-N-benzoylphenylisoserinate

SMILES

COC(=O)[C@H](O)[C@@H](NC(=O)C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChIKey=UYJLJICUXJPKTB-LSDHHAIUSA-N
InChI=1S/C17H17NO4/c1-22-17(21)15(19)14(12-8-4-2-5-9-12)18-16(20)13-10-6-3-7-11-13/h2-11,14-15,19H,1H3,(H,18,20)/t14-,15+/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H17NO4
Molecular Weight 299.3212
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:18:31 GMT 2025
Edited
by admin
on Wed Apr 02 17:18:31 GMT 2025
Record UNII
JCD73C557B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Methyl (2R,3S)-N-benzoylphenylisoserinate
Common Name English
Benzenepropanoic acid, ?-(benzoylamino)-?-hydroxy-, methyl ester, (?R,?S)-
Preferred Name English
Isoserine, N-benzoyl-3-phenyl-, methyl ester, (2R,3S)-
Systematic Name English
Benzenepropanoic acid, ?-(benzoylamino)-?-hydroxy-, methyl ester, [R-(R*,S*)]-
Systematic Name English
Code System Code Type Description
CAS
32981-85-4
Created by admin on Wed Apr 02 17:18:31 GMT 2025 , Edited by admin on Wed Apr 02 17:18:31 GMT 2025
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FDA UNII
JCD73C557B
Created by admin on Wed Apr 02 17:18:31 GMT 2025 , Edited by admin on Wed Apr 02 17:18:31 GMT 2025
PRIMARY
EPA CompTox
DTXSID80186619
Created by admin on Wed Apr 02 17:18:31 GMT 2025 , Edited by admin on Wed Apr 02 17:18:31 GMT 2025
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PUBCHEM
182104
Created by admin on Wed Apr 02 17:18:31 GMT 2025 , Edited by admin on Wed Apr 02 17:18:31 GMT 2025
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