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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL42743
CHEMBL42743
Compound Name TYLOSIN
ChEMBL Synonyms Tylosin | Tylocin Tartarate | E713 | TYLAN
Max Phase 0
Trade Names
Molecular Formula C46H77NO17

Additional synonyms for CHEMBL42743 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CC[C@H]1OC(=O)C[C@@H](O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)[C@@ ...
Download SMILES
Standard InChI InChI=1S/C46H77NO17/c1-13-33-30(22-58-45-42(57-12)41(56-11)3 ...
Download InChI
Standard InChI Key WBPYTXDJUQJLPQ-VMXQISHHSA-N

Sources

  • PubChem BioAssays
  • Scientific Literature
  • USP Dictionary of USAN and International Drug Names

Alternate Forms of Compound in ChEMBL


CHEMBL42743

Molecule Features

CHEMBL42743 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 TYLOSIN
The Cochrane Collaboration TYLOSIN

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
916.1 915.5192 1.83 13 238.67 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
18 5 2 18 5 2


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
13.06 7.39 .63 .38 0 64 0.13

Structural Alerts

There are 12 structural alerts for CHEMBL42743. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:WBPYTXDJUQJLPQ-VMXQISHHSA-N
Wikipedia Tylosin

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL42743



Brenda 6647
ChEBI 17658
FDA SRS YEF4JXN031
KEGG Ligand C01457
LipidMaps LMPK04000004
Metabolights MTBLC17658
MolPort MolPort-003-666-634
PDBe TYK
PubChem 5280440
PubChem: Thomson Pharma 46520802
SureChEMBL SCHEMBL3081
ZINC ZINC000252441679

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