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Details

Stereochemistry ACHIRAL
Molecular Formula C6H5N3O
Molecular Weight 135.1234
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-Deazahypoxanthine

SMILES

O=C1N=CNC2=C1C=CN2

InChI

InChIKey=FBMZEITWVNHWJW-UHFFFAOYSA-N
InChI=1S/C6H5N3O/c10-6-4-1-2-7-5(4)8-3-9-6/h1-3H,(H2,7,8,9,10)

HIDE SMILES / InChI

Molecular Formula C6H5N3O
Molecular Weight 135.1234
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 Tue Apr 01 19:43:06 GMT 2025
Edited
by admin
on Tue Apr 01 19:43:06 GMT 2025
Record UNII
8W6UF5S8F3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-124164
Preferred Name English
7-Deazahypoxanthine
Common Name English
1,7-Dihydropyrrolo[2,3-d]pyrimidin-4-one
Systematic Name English
3,7-Dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
Systematic Name English
NSC-59251
Code English
1H,4H,7H-Pyrrolo[2,3-d]pyrimidin-4-one
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30190281
Created by admin on Tue Apr 01 19:43:06 GMT 2025 , Edited by admin on Tue Apr 01 19:43:06 GMT 2025
PRIMARY
NSC
124164
Created by admin on Tue Apr 01 19:43:06 GMT 2025 , Edited by admin on Tue Apr 01 19:43:06 GMT 2025
PRIMARY
NSC
59251
Created by admin on Tue Apr 01 19:43:06 GMT 2025 , Edited by admin on Tue Apr 01 19:43:06 GMT 2025
PRIMARY
PUBCHEM
96194
Created by admin on Tue Apr 01 19:43:06 GMT 2025 , Edited by admin on Tue Apr 01 19:43:06 GMT 2025
PRIMARY
FDA UNII
8W6UF5S8F3
Created by admin on Tue Apr 01 19:43:06 GMT 2025 , Edited by admin on Tue Apr 01 19:43:06 GMT 2025
PRIMARY
CAS
2768270-52-4
Created by admin on Tue Apr 01 19:43:06 GMT 2025 , Edited by admin on Tue Apr 01 19:43:06 GMT 2025
ALTERNATIVE
CAS
3680-71-5
Created by admin on Tue Apr 01 19:43:06 GMT 2025 , Edited by admin on Tue Apr 01 19:43:06 GMT 2025
PRIMARY