3-MCPD
3-Mono-chloropropane-1,2-diol (3-MCPD) is a contaminant that occurs in food in its free (diol) form as well as in an esterified (with fatty acids) form. Infant formula contains 3-monochloropropane-1,2-diol esters which are formed during the deodorization step of vegetable oils refining.
General
Type :
Chemical_Nomenclature : 3-chloropropane-1,2-diol
Canonical SMILES : C(C(CCl)O)O
InChI : InChI=1S\/C3H7ClO2\/c4-1-3(6)2-5\/h3,5-6H,1-2H2
InChIKey : SSZWWUDQMAHNAQ-UHFFFAOYSA-N
Other name(s) : HOCH2CHOHCH2Cl, 3-Chloro-1,2-propanediol, 3-Chloropropane-1,2-diol, alpha-Chlorohydrin, Chlorodeoxyglycerol, 3-MCDP, CHEBI:18721, SCHEMBL19213, CHEMBL3185949, 3-Monochloropropane-1,2-diol
MW : 110.54
Formula : C3H7ClO2
CAS_number : 96-24-2
PubChem : 7290
UniChem : SSZWWUDQMAHNAQ-UHFFFAOYSA-N
Target
Families : 3-MCPD ligand of proteins in family
Pancreatic_lipase
Protein :
human-PNLIP
References (4)
| Title : Determination of glycidyl esters and 3-MCPD esters in edible oils by sample pretreatment with the combination of lipase hydrolysis and modified QuEChERS for GC-MS analysis - Tsai_2021_J.Food.Drug.Anal_29_153 |
| Author(s) : Tsai HY , Hsu JN , Fang CJ , Su NW |
| Ref : J Food Drug Anal , 29 :153 , 2021 |
| PubMedID: 35696223 |
| Title : Model studies on the formation of monochloropropanediols in the presence of lipase - Robert_2004_J.Agric.Food.Chem_52_5102 |
| Author(s) : Robert MC , Oberson JM , Stadler RH |
| Ref : Journal of Agricultural and Food Chemistry , 52 :5102 , 2004 |
| PubMedID: 15291482 |