Chemical Component Summary

NamePHENYLETHANE BORONIC ACID
Identifiersphenethylboronic acid
FormulaC8 H11 B O2
Molecular Weight149.983
TypeNON-POLYMER
Isomeric SMILESB(CCc1ccccc1)(O)O
InChIInChI=1S/C8H11BO2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5,10-11H,6-7H2
InChIKeyVPRUMANMDWQMNF-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count22
Chiral Atom Count0
Bond Count22
Aromatic Bond Count6

Drug Info: DrugBank

DrugBank IDDB01963 
NamePhenylethane Boronic Acid
Groups experimental
SynonymsPhenylethane Boronic Acid
Categories
  • Acids
  • Acids, Noncarboxylic
  • Boron Compounds
CAS number34420-17-2

Drug Targets

NameTarget SequencePharmacological ActionActions
Chymotrypsinogen BMAFLWLLSCWALLGTTFGCGVPAIHPVLSGLSRIVNGEDAVPGSWPWQVS...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 65389
ChEMBL CHEMBL20461