Summary

IMPPAT Phytochemical identifier: IMPHY012030

Phytochemical name: Uric acid

Synonymous chemical names:
uric acid

External chemical identifiers:
CID:1175, ChEMBL:CHEMBL792, ChEBI:62589, ZINC:ZINC000002041003, FDASRS:268B43MJ25, SureChEMBL:SCHEMBL7933, MolPort-046-938-075

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Chemical structure information

SMILES:
O=c1[nH]c2c([nH]1)[nH]c(=O)[nH]c2=O

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)

InChIKey:
LEHOTFFKMJEONL-UHFFFAOYSA-N

DeepSMILES:
O=c[nH]cc[nH]5)[nH]c=O)[nH]c6=O

Functional groups:
c=O, c[nH]c

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=c1[nH]c(=O)c2[nH]c(=O)[nH]c2[nH]1

Scaffold Graph/Node level:
OC1NC(O)C2NC(O)NC2N1

Scaffold Graph level:
CC1CC(C)C2CC(C)CC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Imidazopyrimidines

ClassyFire Subclass: Purines and purine derivatives

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Pseudoalkaloids

NP Classifier Class: Purine alkaloids

NP-Likeness score: -0.279

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Chemical structure download