U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry ACHIRAL
Molecular Formula C9H10ClN5O2
Molecular Weight 255.661
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Amino-9-(((2-chloroprop-2-en-1-yl)oxy)methyl)-1,9-dihydro-6H-purin-6-one

SMILES

NC1=NC2=C(N=CN2COCC(Cl)=C)C(=O)N1

InChI

InChIKey=SEORDVRCKCNEQT-UHFFFAOYSA-N
InChI=1S/C9H10ClN5O2/c1-5(10)2-17-4-15-3-12-6-7(15)13-9(11)14-8(6)16/h3H,1-2,4H2,(H3,11,13,14,16)

HIDE SMILES / InChI

Molecular Formula C9H10ClN5O2
Molecular Weight 255.661
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:23:05 GMT 2025
Edited
by admin
on Mon Mar 31 21:23:05 GMT 2025
Record UNII
714PGJ743E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GANCICLOVIR IMPURITY A [EP IMPURITY]
Preferred Name English
2-Amino-9-(((2-chloroprop-2-en-1-yl)oxy)methyl)-1,9-dihydro-6H-purin-6-one
Systematic Name English
Code System Code Type Description
FDA UNII
714PGJ743E
Created by admin on Mon Mar 31 21:23:05 GMT 2025 , Edited by admin on Mon Mar 31 21:23:05 GMT 2025
PRIMARY
PUBCHEM
135565423
Created by admin on Mon Mar 31 21:23:05 GMT 2025 , Edited by admin on Mon Mar 31 21:23:05 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY