xanthine-8-carboxylate

Chemical Formula:

C₆H₃N₄O₄

Molecular Weight:

195.114 Daltons

Monoisotopic Mass:

196.0232546376 Daltons

SMILES:

C12(NC(NC(C=1NC(C(=O)[O-])=N2)=O)=O)

InChI:

1S/C6H4N4O4/c11-4-1-2(9-6(14)10-4)8-3(7-1)5(12)13/h(H,12,13)(H3,7,8,9,10,11,14)/p-1

InChIKey:

VRZJGNXBSRQZGM-UHFFFAOYSA-M

Databases

MetaCyc: XANTHINE-8-CARBOXYLATE

ChemSpider: 5256698

PubChem (CID): 6857356

ChEBI: 16806

KEGG: C03314

CAS: 2577-18-6

Seed: cpd02112

MetaNetX: MNXM4880