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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H16N2O4
Molecular Weight 264.2771
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHENYLACETYLISOGLUTAMINE

SMILES

NC(=O)[C@H](CCC(O)=O)NC(=O)CC1=CC=CC=C1

InChI

InChIKey=XBJLFHMAIQTBJX-JTQLQIEISA-N
InChI=1S/C13H16N2O4/c14-13(19)10(6-7-12(17)18)15-11(16)8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H2,14,19)(H,15,16)(H,17,18)/t10-/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H16N2O4
Molecular Weight 264.2771
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 Sat Dec 16 13:33:23 GMT 2023
Edited
by admin
on Sat Dec 16 13:33:23 GMT 2023
Record UNII
GIHVNHYRNQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PHENYLACETYLISOGLUTAMINE
Common Name English
PENTANOIC ACID, 5-AMINO-5-OXO-4-((PHENYLACETYL)AMINO)-, (4S)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID201313412
Created by admin on Sat Dec 16 13:33:23 GMT 2023 , Edited by admin on Sat Dec 16 13:33:23 GMT 2023
PRIMARY
PUBCHEM
9939588
Created by admin on Sat Dec 16 13:33:23 GMT 2023 , Edited by admin on Sat Dec 16 13:33:23 GMT 2023
PRIMARY
CAS
104771-88-2
Created by admin on Sat Dec 16 13:33:23 GMT 2023 , Edited by admin on Sat Dec 16 13:33:23 GMT 2023
PRIMARY
FDA UNII
GIHVNHYRNQ
Created by admin on Sat Dec 16 13:33:23 GMT 2023 , Edited by admin on Sat Dec 16 13:33:23 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT