TETRADECYL SULFURIC ACID

Search structure
Synonyms:
Status: Approved (1946)
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 6VOC18EIBH

Structure
InChI Key GROJOWHVXQYQGN-UHFFFAOYSA-N
Smile CCCCC(CC)CCC(CC(C)C)OS(=O)(=O)O
InChI
InChI=1S/C14H30O4S/c1-5-7-8-13(6-2)9-10-14(11-12(3)4)18-19(15,16)17/h12-14H,5-11H2,1-4H3,(H,15,16,17)

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H30O4S
Molecular Weight 294.46
AlogP 4.22
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 11.0
Polar Surface Area 63.6
Molecular species ACID
Aromatic Rings 0.0
Heavy Atoms 19.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Epigenetic regulator Eraser Histone deacetylase HDAC class IIb
- - - - -7.73-10.39

Cross References

Resources Reference
ChEBI 75275
ChEMBL CHEMBL1201345
DrugBank DB11328
DrugCentral 3550
EPA CompTox DTXSID7047015
FDA SRS 6VOC18EIBH
PubChem 8771
SureChEMBL SCHEMBL2369664
CONTENTS