Chemical Component Summary

Name{4-[2-BENZYL-3-METHOXY-2-(METHOXYCARBONYL)-3-OXOPROPYL]PHENYL}SULFAMIC ACID
Identifiers[4-[3-methoxy-2-methoxycarbonyl-3-oxo-2-(phenylmethyl)propyl]phenyl]sulfamic acid
FormulaC19 H21 N O7 S
Molecular Weight407.438
TypeNON-POLYMER
Isomeric SMILESCOC(=O)C(Cc1ccccc1)(Cc2ccc(cc2)NS(=O)(=O)O)C(=O)OC
InChIInChI=1S/C19H21NO7S/c1-26-17(21)19(18(22)27-2,12-14-6-4-3-5-7-14)13-15-8-10-16(11-9-15)20-28(23,24)25/h3-11,20H,12-13H2,1-2H3,(H,23,24,25)
InChIKeySUACYXRSGYYBGT-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count49
Chiral Atom Count0
Bond Count50
Aromatic Bond Count12

Drug Info: DrugBank

DrugBank IDDB06989 
Name{4-[2-BENZYL-3-METHOXY-2-(METHOXYCARBONYL)-3-OXOPROPYL]PHENYL}SULFAMIC ACID
Groups experimental
Synonyms{4-[2-BENZYL-3-METHOXY-2-(METHOXYCARBONYL)-3-OXOPROPYL]PHENYL}SULFAMIC ACID

Drug Targets

NameTarget SequencePharmacological ActionActions
Receptor-type tyrosine-protein phosphatase betaMLSHGAGLALWITLSLLQTGLAEPERCNFTLAESKASSHSVSIQWRILGS...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
Pharos CHEMBL379000
PubChem 6914659
ChEMBL CHEMBL379000