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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1355
CHEMBL1355
Compound Name SODIUM CITRATE
ChEMBL Synonyms CYSTEMME | CYMALON | ANTICOAGULANT SODIUM CITRATE | MICOLETTE | SODIUM CITRATE | E331 | MICRALAX | SOD CIT | URISAL | RELAXIT | Isolyte E | CYSTOLEVE | CYSTOCALM | CANESTEN OASIS
Max Phase 4 (Approved)
Trade Names CYMALON | CANESTEN OASIS | CYSTOCALM | CYSTOLEVE | Isolyte E | RELAXIT | MICRALAX | SOD CIT | ANTICOAGULANT SODIUM CITRATE | MICOLETTE | URISAL | CYSTEMME
Molecular Formula C6H5Na3O7

Additional synonyms for CHEMBL1355 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES [Na+].[Na+].[Na+].OC(CC(=O)[O-])(CC(=O)[O-])C(=O)[O-]
Standard InChI InChI=1S/C6H8O7.3Na/c7-3(8)1-6(13,5(11)12)2-4(9)10;;;/h13H,1 ...
Download InChI
Standard InChI Key HRXKRNGNAMMEHJ-UHFFFAOYSA-K

Sources

  • British National Formulary
  • Orange Book
  • Scientific Literature
  • USP Dictionary of USAN and International Drug Names
  • WHO Anatomical Therapeutic Chemical Classification

Alternate Forms of Compound in ChEMBL


CHEMBL1355

Molecule Features

CHEMBL1355 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:N First In Class:N Chirality:Unknown Prodrug:N Oral:N Parenteral:Y Topical:N Black Box:N Availability Type:Prescription-only

Clinical Data

ClinicalTrials.gov SODIUM CITRATE
The Cochrane Collaboration SODIUM CITRATE

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
258.1 257.9728 - - - -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
- - - - - -


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

Structural Alerts

There are no structural alerts for CHEMBL1355

Compound Cross References

ATC B - BLOOD AND BLOOD FORMING ORGANS
B05 - BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
B05C - IRRIGATING SOLUTIONS
B05CB - Salt solutions
B05CB02 - sodium citrate

ChemSpider ChemSpider:HRXKRNGNAMMEHJ-UHFFFAOYSA-K
DailyMed sodium citrate
Wikipedia Monosodium_citrate Trisodium_citrate

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1355



ACToR 183748-56-3 68-04-2
Brenda 50894
ChEBI 53258
ChemicalBook CB7360958
DrugBank DB09154
eMolecules 30555533 491937
EPA CompTox Dashboard DTXSID2026363
FDA SRS RS7A450LGA
MolPort MolPort-003-928-578
Nikkaji J1.168A
PubChem 6224 59701732
PubChem: Thomson Pharma 15221431
SureChEMBL SCHEMBL3657

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/HRXKRNGNAMMEHJ-UHFFFAOYSA-K spacer
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