TAM6
General
Type : Benzofuran
Chemical_Nomenclature : ethyl 4-[(dimethylamino)methyl]-5-hydroxy-2-phenyl-1-benzofuran-3-carboxylate
Canonical SMILES : CCOC(=O)C1=C(OC2=C1C(=C(C=C2)O)CN(C)C)C3=CC=CC=C3
InChI : InChI=1S\/C20H21NO4\/c1-4-24-20(23)18-17-14(12-21(2)3)15(22)10-11-16(17)25-19(18)13-8-6-5-7-9-13\/h5-11,22H,4,12H2,1-3H3
InChIKey : JXUHSUSCLWIKEW-UHFFFAOYSA-N
Other name(s) : UNII-R9SEX5R77D,3-benzofurancarboxylic acid, 4-[(dimethylamino)methyl]-5-hydroxy-2-phenyl-, ethyl ester,Phenicaberan [WHO-DD],Phenicaberanum
MW : 339.391
Formula : C20H21NO4
CAS_number :
PubChem : 40122
UniChem : JXUHSUSCLWIKEW-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : TAM6 ligand of proteins in family: Thioesterase
Stucture : 5V40 Crystal Structure of Mtb Pks13 Thioesterase domain in complex with inhibitor TAM6
Protein : myctu-PKS13
References (1)
| Title : Development of a Novel Lead that Targets M. tuberculosis Polyketide Synthase 13 - Aggarwal_2017_Cell_170_249 |
| Author(s) : Aggarwal A , Parai MK , Shetty N , Wallis D , Woolhiser L , Hastings C , Dutta NK , Galaviz S , Dhakal RC , Shrestha R , Wakabayashi S , Walpole C , Matthews D , Floyd D , Scullion P , Riley J , Epemolu O , Norval S , Snavely T , Robertson GT , Rubin EJ , Ioerger TR , Sirgel FA , van der Merwe R , van Helden PD , Keller P , Bottger EC , Karakousis PC , Lenaerts AJ , Sacchettini JC |
| Ref : Cell , 170 :249 , 2017 |
| Abstract : Aggarwal_2017_Cell_170_249 |
| ESTHER : Aggarwal_2017_Cell_170_249 |
| PubMedSearch : Aggarwal_2017_Cell_170_249 |
| PubMedID: 28669536 |
| Gene_locus related to this paper: myctu-PKS13 |