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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL153
CHEMBL153
Compound Name TROLOX
ChEMBL Synonyms Trolox
Max Phase 0
Trade Names
Molecular Formula C14H18O4

Additional synonyms for CHEMBL153 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Cc1c(C)c2OC(C)(CCc2c(C)c1O)C(=O)O
Standard InChI InChI=1S/C14H18O4/c1-7-8(2)12-10(9(3)11(7)15)5-6-14(4,18-12) ...
Download InChI
Standard InChI Key GLEVLJDDWXEYCO-UHFFFAOYSA-N

Alternate Forms of Compound in ChEMBL


CHEMBL153

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
250.3 250.1205 3.49 1 66.76 ACID


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
3.35 - 2.46 -1.11 1 18 0.8

Structural Alerts

There are no structural alerts for CHEMBL153

Compound Cross References

ChemSpider ChemSpider:GLEVLJDDWXEYCO-UHFFFAOYSA-N
PubChem SID: 56463570
Wikipedia Trolox

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL153



ACToR 56305-04-5 53188-07-1
BindingDB 50359629
ChEBI 82625
eMolecules 490919
Human Metabolome Database HMDB38804
IBM Patent System E55437558DF44D24E436DFE65DA79F0F
LINCS LSM-4987
Mcule MCULE-8649288753
MolPort MolPort-001-738-524
Nikkaji J236.392E
NMRShiftDB 75045
PubChem 40634
PubChem: Thomson Pharma 14774309
SureChEMBL SCHEMBL3226

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