MiMeDB: Showing metabocard for Tetradecanoyl chloride

Microbial

Human

Record Information

Version

2.0

Status

Detected and Quantified

Creation Date

2025-10-03 10:41:14 UTC

Update Date

2025-10-08 21:36:21 UTC

Metabolite ID

MMDBc0061621

Metabolite Identification

Common Name

Tetradecanoyl chloride_L-leucine

Description

Tetradecanoyl chloride_L-leucine is a fatty acyl derivative of the amino acid L-leucine, belonging to the class of acyl chlorides. Currently, there is little literature available on this metabolite, indicating a gap in research and understanding of its biological significance and potential applications.

Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Molecular Formula

C₂₀H₃₉NO₃

Average Mass

341.536

Monoisotopic Mass

341.29299412

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

Not Available

InChI Identifier

Not Available

InChI Key

GAYBJDZLMVRVKL-SFHVURJKSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as leucine and derivatives. Leucine and derivatives are compounds containing leucine or a derivative thereof resulting from reaction of leucine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Amino acids, peptides, and analogues

Direct Parent

Leucine and derivatives

Alternative Parents

Substituents

Leucine or derivatives
N-acyl-alpha-amino acid
N-acyl-alpha amino acid or derivatives
N-acyl-l-alpha-amino acid
Branched fatty acid
Methyl-branched fatty acid
Fatty amide
N-acyl-amine
Fatty acid
Fatty acyl
Secondary carboxylic acid amide
Carboxamide group
Monocarboxylic acid or derivatives
Carboxylic acid
Organooxygen compound
Organonitrogen compound
Organopnictogen compound
Organic oxygen compound
Organic nitrogen compound
Organic oxide
Carbonyl group
Hydrocarbon derivative
Aliphatic acyclic compound

Molecular Framework

Aliphatic acyclic compounds

External Descriptors

Not Available

Functional Ontology

Not Available

Physical Properties

State

Not Available

Predicted Properties

Not Available

Spectra

Not Available

Chromatographic Retention Times and Retention Indices

Retention Times

Not Available

Retention Indices

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

Protein ID	Protein Name	Protein Type	Uniprot ID	Species

Human Pathways

Pathways

Name	SMPDB/PathBank

Microbial Pathways

Pathways

Not Available

Metabolic Reactions

Reactions

This table shows at most 20 reactions. For the full list of associated reactions:

See All Associated Reactions

Reaction ID	Precursor	Product	Enzyme	Reaction Type	Data Source	Reference

Health Effects and Bioactivity

Health Outcome/Bioactivity	Metabolite Response/Effect	Evidence Type	Host and Biospecimen	Data Source	Reference

Microbial Sources

Superkingdom/Kingdom	Phylum	Total species	Hosts and Body Sites	Microbial Links
Bacteria	Proteobacteria	5	Human saliva; Human feces; Human sputum; Human mucosa; Human urine; Human supragingival plaque; Human	Microbial culture
Bacteria/Eubacteria	Proteobacteria	2	Human saliva; Human feces; Human sputum; Human mucosa; Human urine; Human supragingival plaque; Human	Microbial culture
Bacteria/Eubacteria	nah	1	Human ; Human feces; Human sputum	Microbial culture
Bacteria/Eubacteria	Bacteroidetes	1	Human feces; Human	Microbial culture

Exposure Sources

Other Exposures

Source Type	Data Source	Reference

Host Biospecimen and Location

Host and Biospecimen	Status	Mean	Std	Min	Max	Units	Age	Sex	Health Condition	Data Source	Reference

External Links

HMDB ID

Not Available

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

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

53828694

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

CMMC Knowledgebase

GAYBJDZLMVRVKL-SFHVURJKSA-N

General References

Collaborative Microbial Metabolite Center Knowledgebase [Link]

Showing metabocard for Tetradecanoyl chloride_L-leucine (MMDBc0061621)

MOL for #<Metabolite:0x00007f2ddffb4758>

3D MOL for #<Metabolite:0x00007f2ddffb4758>

3D SDF for #<Metabolite:0x00007f2ddffb4758>

3D-SDF for #<Metabolite:0x00007f2ddffb4758>

PDB for #<Metabolite:0x00007f2ddffb4758>

3D PDB for #<Metabolite:0x00007f2ddffb4758>

SMILES for #<Metabolite:0x00007f2ddffb4758>

INCHI for #<Metabolite:0x00007f2ddffb4758>

Structure for #<Metabolite:0x00007f2ddffb4758>

3D Structure for #<Metabolite:0x00007f2ddffb4758>