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

Details

Stereochemistry ACHIRAL
Molecular Formula C5H4N4
Molecular Weight 120.1121
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PURINE

SMILES

N1C=NC2=C1C=NC=N2

InChI

InChIKey=KDCGOANMDULRCW-UHFFFAOYSA-N
InChI=1S/C5H4N4/c1-4-5(8-2-6-1)9-3-7-4/h1-3H,(H,6,7,8,9)

HIDE SMILES / InChI

Molecular Formula C5H4N4
Molecular Weight 120.1121
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

Substance Class Chemical
Record UNII
W60KTZ3IZY
Record Status Validated (UNII)
Record Version