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

Details

Stereochemistry ACHIRAL
Molecular Formula C6H3N7O3
Molecular Weight 221.1331
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CYAMELURIC ACID

SMILES

O=C1NC2=NC(=O)NC3=NC(=O)N=C(N1)N23

InChI

InChIKey=PBKYCCOBOHDCIT-UHFFFAOYSA-N
InChI=1S/C6H3N7O3/c14-4-7-1-8-5(15)10-3-12-6(16)11-2(9-4)13(1)3/h(H3,7,8,9,10,11,12,14,15,16)

HIDE SMILES / InChI

Molecular Formula C6H3N7O3
Molecular Weight 221.1331
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

Substance Class Chemical
Record UNII
FC54F41J58
Record Status Validated (UNII)
Record Version