BECBA

Product of hydrolysis of 3PET. Hydrolyzed in MHET and BA

General

Type : Terephthalate, Phthalate

Chemical_Nomenclature : 4-(2-benzoyloxyethoxycarbonyl)benzoic acid

Canonical SMILES : C1=CC=C(C=C1)C(=O)OCCOC(=O)C2=CC=C(C=C2)C(=O)O

InChI : InChI=1S\/C17H14O6\/c18-15(19)12-6-8-14(9-7-12)17(21)23-11-10-22-16(20)13-4-2-1-3-5-13\/h1-9H,10-11H2,(H,18,19)

InChIKey : GELYKMNJWXZNIX-UHFFFAOYSA-N

Other name(s) : DTXSID501017835


MW : 314.29

Formula : C17H14O6

CAS_number :

PubChem : 145865721

UniChem : GELYKMNJWXZNIX-UHFFFAOYSA-N

Target

Structures : No structure

Families : Carb_B_Bacteria

References (1)

Title : Structural Insights into (Tere)phthalate-Ester Hydrolysis by a Carboxylesterase and Its Role in Promoting PET Depolymerization - von Haugwitz_2022_ACS.Catal_12_15259
Author(s) : von Haugwitz G , Han X , Pfaff L , Li Q , Wei H , Gao J , Methling K , Ao Y , Brack Y , Jan Mican J , Feiler CG , Weiss MS , Bednar D , Palm GJ , Lalk M , Lammers M , Damborsky J , Weber G , Liu W , Bornscheuer UT , Wei R
Ref : ACS Catal , 12 :15259 , 2022
Abstract :
PubMedSearch : von Haugwitz_2022_ACS.Catal_12_15259
PubMedID: 36570084
Gene_locus related to this paper: thefu-1831