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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL497613
CHEMBL497613
Compound Name FLUDEOXYGLUCOSE-F18
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula C6H11FO5

Additional synonyms for CHEMBL497613 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES OC[C@H]1O[C@@H](O)[C@H]([18F])[C@@H](O)[C@@H]1O
Standard InChI InChI=1S/C6H11FO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1 ...
Download InChI
Standard InChI Key ZCXUVYAZINUVJD-RCVQEXLNSA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL497613

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
182.2 182.0591 -2.24 1 90.15 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
5 4 0 5 4 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
11.48 - -1.47 -1.47 0 12 0.37

Structural Alerts

There are 1 structural alerts for CHEMBL497613. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:ZCXUVYAZINUVJD-RCVQEXLNSA-N
Wikipedia Fludeoxyglucose_(18F)

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL497613



ChEBI 49131
FDA SRS 7R6S3C8YL2
Nikkaji J227.715H
PubChem 9920539
PubChem: Thomson Pharma 14891854
ZINC ZINC000100079033

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/ZCXUVYAZINUVJD-RCVQEXLNSA-N spacer
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