4-(Phenoxyethylphosphoryl)methylbenzoate
General
Type : Analogue of substrate, Benzoate, Organophosphate
Chemical_Nomenclature : (4-methoxycarbonylphenyl)-(2-phenylmethoxyethoxy)phosphinic acid
Canonical SMILES : COC(=O)C1=CC=C(C=C1)P(=O)(O)OCCOCC2=CC=CC=C2
InChI : InChI=1S\/C17H19O6P\/c1-21-17(18)15-7-9-16(10-8-15)24(19,20)23-12-11-22-13-14-5-3-2-4-6-14\/h2-10H,11-13H2,1H3,(H,19,20)
InChIKey : XPCSDQWUXIAMMN-UHFFFAOYSA-N
Other name(s) : a12 || a012 || A1L0M
MW : 336.281
Formula : C16H17O6P
CAS_number :
PubChem : 172408433
UniChem : XPCSDQWUXIAMMN-UHFFFAOYSA-N
methylbenzoate.gif)
Target
Families : 4-(Phenoxyethylphosphoryl)methylbenzoate ligand of proteins in family
Polyesterase-lipase-cutinase
Structure :
8Z2J
Protein :
sacvd-c7mve8
References (1)
| Title : Structural dynamics of the Ca(2+)-regulated cutinase towards structure-based improvement of PET degradation activity - Numoto_2024_Int.J.Biol.Macromol_281_136597 |
| Author(s) : Numoto N , Kondo F , Bekker GJ , Liao Z , Yamashita M , Iida A , Ito N , Kamiya N , Oda M |
| Ref : Int J Biol Macromol , 281 :136597 , 2024 |
| Abstract : |
| PubMedSearch : Numoto_2024_Int.J.Biol.Macromol_281_136597 |
| PubMedID: 39419144 |
| Gene_locus related to this paper: sacvd-c7mve8 |