TMR-T4

Type : HaloTag-ligand,Sulfur Compound,Sulfonamide,Xanthene

Chemical_Nomenclature : [9-[2-carboxy-5-[2-[2-[4-(trifluoromethylsulfonylamino)butoxy]ethoxy]ethylcarbamoyl]phenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethyl-azanium

Canonical SMILES : CN(C)c1ccc2c(c1)OC3=CC(=[N+](C)C)C=CC3=C2c4cc(ccc4C(=O)O)C(=O)NCCOCCOCCCCNS(=O)(=O)C(F)(F)F

InChI : InChI=1S\/C34H39F3N4O8S\/c1-40(2)23-8-11-26-29(20-23)49-30-21-24(41(3)4)9-12-27(30)31(26)28-19-22(7-10-25(28)33(43)44)32(42)38-14-16-48-18-17-47-15-6-5-13-39-50(45,46)34(35,36)37\/h7-12,19-21,39H,5-6,13-18H2,1-4H3,(H-,38,42,43,44)\/p+1

InChIKey : CKSQAQHVRBNIHM-UHFFFAOYSA-O

Other name(s) : IYE,[9-[2-carboxy-5-[2-[2-[4-(trifluoromethylsulfonylamino)butoxy]ethoxy]ethylcarbamoyl]phenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethyl-azanium

MW : 721.76

Formula : C34H40F3N4O8S

CAS_number :

PubChem :

UniChem : CKSQAQHVRBNIHM-UHFFFAOYSA-O

IUPHAR :

Wikipedia :

Families : TMR-T4 ligand of proteins in family: Haloalkane_dehalogenase-HLD2

Stucture : 7ZIW X-ray structure of the haloalkane dehalogenase HaloTag7 bound to a butyltrifluoromethanesulfonamide tetramethylrhodamine ligand (TMR-T4)

Protein : rhoso-halo1