MiMeDB: Showing metabocard for Schizokinen (MMDBc0027359)

Microbial

Record Information

Version

1.0

Status

Detected and Quantified

Creation Date

2021-05-15 17:04:49 UTC

Update Date

2022-08-12 20:03:05 UTC

Metabolite ID

MMDBc0027359

Metabolite Identification

Common Name

Schizokinen

Description

schizokinen belongs to the class of organic compounds known as hydroxy fatty acids. These are fatty acids in which the chain bears a hydroxyl group. schizokinen is an extremely weak basic (essentially neutral) compound (based on its pKa).

Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Molecular Formula

C₁₆H₂₈N₄O₉

Average Mass

420.419

Monoisotopic Mass

420.185628498

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C16H28N4O9/c1-11(21)19(28)7-3-5-17-13(23)9-16(27,15(25)26)10-14(24)18-6-4-8-20(29)12(2)22/h27-29H,3-10H2,1-2H3,(H,17,23)(H,18,24)(H,25,26)

InChI Key

YILWWVUXGMGOAM-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as hydroxy fatty acids. These are fatty acids in which the chain bears a hydroxyl group.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Fatty Acyls

Sub Class

Fatty acids and conjugates

Direct Parent

Hydroxy fatty acids

Alternative Parents

Substituents

Branched fatty acid
Hydroxy fatty acid
Alpha-hydroxy acid
Fatty amide
Hydroxy acid
N-acyl-amine
Acetohydroxamic acid
Acetamide
Tertiary alcohol
Carboxamide group
Hydroxamic acid
Secondary carboxylic acid amide
Carboxylic acid derivative
Carboxylic acid
Monocarboxylic acid or derivatives
Hydrocarbon derivative
Organic oxide
Alcohol
Organopnictogen compound
Carbonyl group
Organic oxygen compound
Organooxygen compound
Organonitrogen compound
Organic nitrogen compound
Aliphatic acyclic compound

Molecular Framework

Aliphatic acyclic compounds

External Descriptors

hydroxamic acid (CHEBI:84582 )
2-hydroxy carboxylic acid (CHEBI:84582 )

Functional Ontology

Not Available

Physical Properties

State

Expected Solid

Predicted Properties

Not Available

Spectra

Spectrum Type	Description	Splash Key	Deposition Date	View

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	Firmicutes	1	Human feces; Human	Metabolic reconstruction
Bacteria	Actinobacteria	59	Human	Microbial culture
Bacteria/Eubacteria	Actinobacteria	2	Human	Microbial culture
Bacteria/Eubacteria	Bacteroidetes	1	Human ; Goat digesta; Sheep digesta; Human feces; Human sputum; Human supragingival plaque; Human saliva; Human urine; Human subgingival plaque; Human mucosa; Human vaginal fluid	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

Not Available

PDB ID

Not Available

ChEBI ID

84582

Food Biomarker Ontology

Not Available

CMMC Knowledgebase

Not Available

General References

Showing metabocard for Schizokinen (MMDBc0027359)

MOL for #<Metabolite:0x00005560b1679578>

3D MOL for #<Metabolite:0x00005560b1679578>

3D SDF for #<Metabolite:0x00005560b1679578>

3D-SDF for #<Metabolite:0x00005560b1679578>

PDB for #<Metabolite:0x00005560b1679578>

3D PDB for #<Metabolite:0x00005560b1679578>

SMILES for #<Metabolite:0x00005560b1679578>

INCHI for #<Metabolite:0x00005560b1679578>

Structure for #<Metabolite:0x00005560b1679578>

3D Structure for #<Metabolite:0x00005560b1679578>