Record Information Version 1.0 Status Detected and Quantified Creation Date 2021-11-18 01:54:36 UTC Update Date 2022-08-31 18:26:16 UTC MiMeDB ID MMDBc0031911 Metabolite Identification Common Name Enzyme N6-(dihydrolipoyl)lysine Description NULL Structure Synonyms Value Source (e)-3-Chloro-2-propen-1-ol ChEBI (e)-3-Chloroallyl alcohol ChEBI trans-3-Chloroallyl alcohol ChEBI 3-Chloroallyl alcohol, (e)-isomer HMDB 3-Chloroallyl alcohol, (Z)-isomer HMDB 3-Chloro-2-propen-1-ol HMDB 3-Chloroallyl alcohol HMDB trans-3-chloro-2-Propene-1-ol ChEBI
Chemical Formula C3 H5 ClO Average Molecular Weight 92.524 Monoisotopic Molecular Weight 92.002892489 IUPAC Name Not Available Traditional Name Not Available CAS Registry Number Not Available SMILES Not Available InChI Identifier InChI=1S/C3H5ClO/c4-2-1-3-5/h1-2,5H,3H2/b2-1+
InChI Key HJGHXDNIPAWLLE-OWOJBTEDSA-N Chemical Taxonomy Description Belongs to the class of organic compounds known as vinyl chlorides. These are vinyl halides in which a chlorine atom is bonded to an sp2-hybridised carbon atom. Kingdom Organic compounds Super Class Organohalogen compounds Class Vinyl halides Sub Class Vinyl chlorides Direct Parent Vinyl chlorides Alternative Parents Substituents Chloroalkene
Haloalkene
Vinyl chloride
Organic oxygen compound
Hydrocarbon derivative
Primary alcohol
Organooxygen compound
Organochloride
Alcohol
Aliphatic acyclic compound Molecular Framework Aliphatic acyclic compounds External Descriptors Functional Ontology Not Available Physical Properties State Expected Solid Predicted Properties Not Available Spectra Not Available Biological Properties Cellular Locations Not Available Biospecimen Locations Not Available Tissue Locations Not Available Associated OMIM IDs 114500 (Colorectal cancer)610247 (Eosinophilic esophagitis)Human Proteins and Enzymes Proteins #<MetaboliteProteinLink:0x00007f0920061708> Human Pathways Pathways Metabolic Reactions Not Available
Health Effects and Bioactivity Health Outcome/Bioactivity Metabolite Response/Effect Related Health Condition Evidence Type Measured in Matrix Data Source Reference
Microbial Sources Kingdom Phylum Total species Hosts and Body Sites Microbial Links Proteobacteria 1 Human Unknown
Exposure Sources Source Type Source Sub-type Species Data Source Reference Details
Host Biospecimen and Location Host and Biospecimen Status Mean Std Min Max Units Age Sex Health Condition Data Source Reference
External Links HMDB ID HMDB0060514 DrugBank ID Not Available Phenol Explorer Compound ID Not Available FooDB ID Not Available KNApSAcK ID Not Available Chemspider ID Not Available KEGG Compound ID C06611 BioCyc ID Not Available BiGG ID Not Available Wikipedia Link Not Available METLIN ID Not Available PubChem Compound 287955 PDB ID Not Available ChEBI ID 28960 Food Biomarker Ontology Not Available References Synthesis Reference Not Available General References Magrane M: UniProt Knowledgebase: a hub of integrated protein data. Database (Oxford). 2011 Mar 29;2011:bar009. doi: 10.1093/database/bar009. Print 2011. [PubMed:21447597 ]
