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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL511015
CHEMBL511015
Compound Name TENUAZONIC ACID
ChEMBL Synonyms tenuazonic acid
Max Phase 0
Trade Names
Molecular Formula C10H15NO3

Additional synonyms for CHEMBL511015 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CC[C@H](C)[C@@H]1NC(=O)C(=C1O)C(=O)C
Standard InChI InChI=1S/C10H15NO3/c1-4-5(2)8-9(13)7(6(3)12)10(14)11-8/h5,8, ...
Download InChI
Standard InChI Key CEIZFXOZIQNICU-XNCJUZBTSA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL511015

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
197.2 197.1052 0.93 3 66.4 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
3 2 0 4 2 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
4.5 - .59 -2.49 0 14 0.66

Structural Alerts

There are 2 structural alerts for CHEMBL511015. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:CEIZFXOZIQNICU-XNCJUZBTSA-N
Wikipedia Tenuazonic_acid

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL511015



Brenda 218013
eMolecules 594795
FDA SRS Y2J8Y1TO29
Nikkaji J8.138H
PubChem 54683011
ZINC ZINC000095671351

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