Chemical Component Summary

Name3-(4-IODO-PHENYL)-2-MERCAPTO-PROPIONIC ACID
SynonymsPD150606
Identifiers(2S)-3-(4-iodophenyl)-2-sulfanyl-propanoic acid
FormulaC9 H9 I O2 S
Molecular Weight308.136
TypeNON-POLYMER
Isomeric SMILESc1cc(ccc1C[C@@H](C(=O)O)S)I
InChIInChI=1S/C9H9IO2S/c10-7-3-1-6(2-4-7)5-8(13)9(11)12/h1-4,8,13H,5H2,(H,11,12)/t8-/m0/s1
InChIKeyMXQYDIIKDPMYMF-QMMMGPOBSA-N

Chemical Details

Formal Charge0
Atom Count22
Chiral Atom Count1
Bond Count22
Aromatic Bond Count6

Drug Info: DrugBank

DrugBank IDDB02570 
NamePD150606
Groups experimental
SynonymsPD150606
CategoriesAcids, Acyclic

Drug Targets

NameTarget SequencePharmacological ActionActions
Calpain small subunit 1MFLVNSFLKGGGGGGGGGGGLGGGLGNVLGGLISGAGGGGGGGGGGGGGG...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 444306