MiMeDB: Showing metabocard for Avenasterol (MMDBc0052885)

Record Information

Version

1.0

Status

Detected and Quantified

Creation Date

2022-05-16 21:08:02 UTC

Update Date

2022-09-01 02:19:33 UTC

Metabolite ID

MMDBc0052885

Metabolite Identification

Common Name

Avenasterol

Description

Isofucosterol, also known as delta5-avenasterol, is a phytosterol. Phytosterols, or plant sterols, are compounds that occur naturally and bear a close structural resemblance to cholesterol but have different side-chain configurations. Phytosterols are relevant in pharmaceuticals (production of therapeutic steroids), nutrition (anti-cholesterol additives in functional foods, anti-cancer properties), and cosmetics (creams, lipstick). Phytosterols can be obtained from vegetable oils or from industrial wastes, which gives an added value to the latter. Considerable efforts have been recently dedicated to the development of efficient processes for phytosterol isolation from natural sources. The present work aims to summarize information on the applications of phytosterols and to review recent approaches, mainly from the industry, for the large-scale recovery of phytosterols (PMID: 17123816 , 16481154 ). Isofucosterol is found to be associated with phytosterolemia, which is an inborn error of metabolism.

Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Molecular Formula

C₂₉H₄₈O

Average Mass

412.702

Monoisotopic Mass

412.370516166

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,10,19-20,23-27,30H,8-9,11-18H2,1-6H3/b21-7-/t20-,23+,24+,25-,26+,27+,28+,29-/m1/s1

InChI Key

OSELKOCHBMDKEJ-WGMIZEQOSA-N

Chemical Taxonomy

Functional Ontology

Not Available

Physical Properties

State

Expected Solid

Predicted Properties

Not Available

Spectra

Chromatographic Retention Times and Retention Indices

Retention Times

Not Available

Retention Indices

Not Available

Chromatographic Retention Times and Retention Indices

Retention Times

Not Available

Retention Indices

Not Available

Biological Properties

Cellular Locations

Extracellular
Membrane

Biospecimen Locations

Blood

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
MMDBp0192195	7-dehydrocholesterol reductase	Enzyme	Q9UBM7	Homo_sapiens
MMDBp0193337	Delta(24)-sterol reductase	Unknown	Q15392	Homo_sapiens

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
Sitosterolemia	Increased	Association	Human Blood	HMDB	7595097

Microbial Sources

Superkingdom/Kingdom	Phylum	Total species	Hosts and Body Sites	Microbial Links
Eukaryota/Fungi	Basidiomycota	8	Human feces
Eukaryota/Fungi	Ascomycota	2

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
Human	Detected and Quantified	106.4	1.94				Adult (>18 years old)	Both	Phytosterolemia	HMDB	7595097
Human	Detected and Quantified	1.45	0.48				Adult (>18 years old)	Both	Normal	HMDB	7595097

External Links

Not Available

General References

Perona JS, Cabello-Moruno R, Ruiz-Gutierrez V: The role of virgin olive oil components in the modulation of endothelial function. J Nutr Biochem. 2006 Jul;17(7):429-45. doi: 10.1016/j.jnutbio.2005.11.007. Epub 2005 Dec 12. [PubMed:16481154 ]
Fernandes P, Cabral JM: Phytosterols: applications and recovery methods. Bioresour Technol. 2007 Sep;98(12):2335-50. doi: 10.1016/j.biortech.2006.10.006. Epub 2006 Nov 22. [PubMed:17123816 ]

Showing metabocard for Avenasterol (MMDBc0052885)

MOL for #<Metabolite:0x00007f1240716160>

3D MOL for #<Metabolite:0x00007f1240716160>

3D SDF for #<Metabolite:0x00007f1240716160>

3D-SDF for #<Metabolite:0x00007f1240716160>

PDB for #<Metabolite:0x00007f1240716160>

3D PDB for #<Metabolite:0x00007f1240716160>

SMILES for #<Metabolite:0x00007f1240716160>

INCHI for #<Metabolite:0x00007f1240716160>

Structure for #<Metabolite:0x00007f1240716160>

3D Structure for #<Metabolite:0x00007f1240716160>