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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL256105
CHEMBL256105
Compound Name MONENSIN
ChEMBL Synonyms 67314 | COBAN [AS SODIUM SALT] | MONENSIN SODIUM | RUMENSIN [AS SODIUM SALT] | MONENSIN | E714
Max Phase 0
Trade Names
Molecular Formula C36H62O11

Additional synonyms for CHEMBL256105 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CC[C@]1(CC[C@@H](O1)[C@]2(C)CC[C@]3(C[C@H](O)[C@@H](C)[C@H]( ...
Download SMILES
Standard InChI InChI=1S/C36H62O11/c1-10-34(31-20(3)16-26(43-31)28-19(2)15-2 ...
Download InChI
Standard InChI Key GAOZTHIDHYLHMS-KEOBGNEYSA-N

Sources

  • Gene Expression Atlas Compounds
  • Harvard Malaria Screening
  • PubChem BioAssays
  • Scientific Literature
  • TP-search Transporter Database
  • USP Dictionary of USAN and International Drug Names

Alternate Forms of Compound in ChEMBL


CHEMBL256105

Molecule Features

CHEMBL256105 compound icon
Drug Type:Natural Product-derived Rule of Five:N First In Class:N Chirality:Single Stereoisomer Prodrug:N Oral:Unclassified Parenteral:Unclassified Topical:Unclassified Black Box:Unclassified Availability Type:Unclassified

Clinical Data

ClinicalTrials.gov MONENSIN
The Cochrane Collaboration MONENSIN

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
670.9 670.4292 4.27 10 153.37 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
10 4 1 11 4 2


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
4.26 - 4.01 .96 0 47 0.26

Structural Alerts

There are 5 structural alerts for CHEMBL256105. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:GAOZTHIDHYLHMS-KEOBGNEYSA-N
Wikipedia Monensin

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL256105



ACToR 17090-79-8
Atlas monensin
Brenda 151028 7419 118300 145974
ChEBI 27617
EPA CompTox Dashboard DTXSID4048561
FDA SRS 906O0YJ6ZP
IBM Patent System 50BDECAA9ED62C988857EA502B9C11CC
KEGG Ligand C06693
LINCS LSM-5659
Nikkaji J39.488B
PubChem 441145
PubChem: Thomson Pharma 14839569 14912872
SureChEMBL SCHEMBL55367
ZINC ZINC000008143466

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