TAM5
General
Type : Benzofuran,Morpholine
Chemical_Nomenclature : ethyl 5-hydroxy-4-(morpholin-4-ylmethyl)-2-phenyl-1-benzofuran-3-carboxylate
Canonical SMILES : CCOC(=O)C1=C(OC2=C1C(=C(C=C2)O)CN3CCOCC3)C4=CC=CC=C4
InChI : InChI=1S\/C22H23NO5\/c1-2-27-22(25)20-19-16(14-23-10-12-26-13-11-23)17(24)8-9-18(19)28-21(20)15-6-4-3-5-7-15\/h3-9,24H,2,10-14H2,1H3
InChIKey : OGXGATRCXHSTEV-UHFFFAOYSA-N
Other name(s) : MLS000061958,SMR000070819,Ethyl 5-hydroxy-4-(4-morpholinylmethyl)-2-phenyl-1-benzofuran-3-carboxylate,80592-84-3,BAS 01057783
MW : 381.42
Formula : C22H23NO5
CAS_number :
PubChem : 1113703
UniChem : OGXGATRCXHSTEV-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : TAM5 ligand of proteins in family: Thioesterase
Stucture : 5V41 Crystal Structure of Mtb Pks13 Thioesterase domain in complex with inhibitor TAM5
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 |