Chemical Components in the PDB

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URC : Summary

Code

URC

One-letter code

X

Molecule name

URIC ACID

Synonyms

7,9-DIHYDRO-1H-PURINE-2,6,8(3H)-TRIONE

Systematic names

ProgramVersionName
ACDLabs 10.04 7,9-dihydro-1H-purine-2,6,8(3H)-trione
OpenEye OEToolkits 1.5.0 7,9-dihydro-3H-purine-2,6,8-trione

Formula

C5 H4 N4 O3

Formal charge

0

Molecular weight

168.11 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 O=C1C2=C(NC(=O)N1)NC(=O)N2
SMILES CACTVS 3.341 O=C1NC(=O)C2=C(N1)NC(=O)N2
SMILES OpenEye OEToolkits 1.5.0 C12=C(NC(=O)N1)NC(=O)NC2=O
Canonical SMILES CACTVS 3.341 O=C1NC(=O)C2=C(N1)NC(=O)N2
Canonical SMILES OpenEye OEToolkits 1.5.0 C12=C(NC(=O)N1)NC(=O)NC2=O

IUPAC InChI

InChI=1S/C5H4N4O3/c10-3-1-2(7-4(11)6-1)8-5(12)9-3/h(H4,6,7,8,9,10,11,12)

IUPAC InChI key

LEHOTFFKMJEONL-UHFFFAOYSA-N
URC

wwPDB Information

Atom count

16 (12 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2002-03-15

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned