U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C5H5N5O2
Molecular Weight 167.1255
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GUANINE 7-OXIDE

SMILES

NC1=NC2=C(C(=O)N1)[N+]([O-])=CN2

InChI

InChIKey=VWMKKTYDXHGESB-UHFFFAOYSA-N
InChI=1S/C5H5N5O2/c6-5-8-3-2(4(11)9-5)10(12)1-7-3/h1H,(H4,6,7,8,9,11)

HIDE SMILES / InChI

Molecular Formula C5H5N5O2
Molecular Weight 167.1255
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 Sat Dec 16 08:37:48 GMT 2023
Edited
by admin
on Sat Dec 16 08:37:48 GMT 2023
Record UNII
VV6PV58VBZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GUANINE 7-OXIDE
Systematic Name English
NSC-353056
Code English
Antibiotic PD 113876
Common Name English
Guanine 7-N-oxide
Common Name English
Antibiotic 3780
Common Name English
PD-113876
Code English
2-Amino-6-oxo-6,9-dihydro-1H-purin-7-ium-7-olate
Systematic Name English
2-Amino-6-oxo-6,9-dihydro-1H-purine 7-oxide
Systematic Name English
6H-Purin-6-one, 2-amino-1,9-dihydro-, 7-oxide
Systematic Name English
Code System Code Type Description
CAS
5227-68-9
Created by admin on Sat Dec 16 08:37:48 GMT 2023 , Edited by admin on Sat Dec 16 08:37:48 GMT 2023
PRIMARY
FDA UNII
VV6PV58VBZ
Created by admin on Sat Dec 16 08:37:48 GMT 2023 , Edited by admin on Sat Dec 16 08:37:48 GMT 2023
PRIMARY
NSC
353056
Created by admin on Sat Dec 16 08:37:48 GMT 2023 , Edited by admin on Sat Dec 16 08:37:48 GMT 2023
PRIMARY
EPA CompTox
DTXSID10966643
Created by admin on Sat Dec 16 08:37:48 GMT 2023 , Edited by admin on Sat Dec 16 08:37:48 GMT 2023
PRIMARY