MiMeDB: Showing metabocard for Aromatic amino acid (MMDBc0031941)

Record Information

Version

1.0

Status

Detected and Quantified

Creation Date

2021-11-18 01:55:53 UTC

Update Date

2024-10-17 07:23:29 UTC

Metabolite ID

MMDBc0031941

Metabolite Identification

Common Name

Aromatic amino acid

Description

Amino acids that include an aromatic ring

Structure

MOL SDF PDB SMILES InChI

Synonyms

Value	Source
(+-)-5-Hydroxytryptophan	ChEBI
5-HTP	ChEBI
5-Hydroxy-DL-tryptophan	ChEBI
5-Hydroxytryptophan DL-form	ChEBI
DL-5-HTP	ChEBI
DL-5-Hydroxytryptophan	ChEBI
(S)-5-Hydroxytryptophan	HMDB
5-Hydroxy-tryptophan	HMDB
5-Hydroxyl-L-tryptophan	HMDB
5-Hydroxytryptophan	HMDB, MeSH
5-Hydroxytryptophan L form	HMDB
5-Hydroxytryptophan L-form	HMDB
Cincofarm	HMDB
Hydroxytryptophan	HMDB, MeSH
L-5-Hydroxytryptophan	HMDB
Levothym	HMDB
Levotinine	HMDB
Oxitriptan	HMDB, MeSH
Oxyfan	HMDB
Oxytryptophan	HMDB, MeSH
Pretonine	HMDB
Quietim	HMDB
Serotonyl	HMDB
Telesol	HMDB
Triptene	HMDB
5 Hydroxytryptophan	MeSH
5-Hydroxy- tryptophan	MeSH
Tryptophan, 5 hydroxy	MeSH

Molecular Formula

C₁₁H₁₂N₂O₃

Average Mass

220.2246

Monoisotopic Mass

220.08479226

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C11H12N2O3/c12-9(11(15)16)3-6-5-13-10-2-1-7(14)4-8(6)10/h1-2,4-5,9,13-14H,3,12H2,(H,15,16)

InChI Key

LDCYZAJDBXYCGN-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as serotonins. Serotonins are compounds containing a serotonin moiety, which consists of an indole that bears an aminoethyl a position 2 and a hydroxyl group at position 5.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Indoles and derivatives

Sub Class

Tryptamines and derivatives

Direct Parent

Serotonins

Alternative Parents

Substituents

Serotonin
Indolyl carboxylic acid derivative
Alpha-amino acid
Alpha-amino acid or derivatives
Hydroxyindole
3-alkylindole
Indole
1-hydroxy-2-unsubstituted benzenoid
Aralkylamine
Substituted pyrrole
Benzenoid
Pyrrole
Heteroaromatic compound
Amino acid
Amino acid or derivatives
Azacycle
Carboxylic acid derivative
Carboxylic acid
Monocarboxylic acid or derivatives
Hydrocarbon derivative
Organonitrogen compound
Primary aliphatic amine
Organic oxide
Organopnictogen compound
Organooxygen compound
Primary amine
Carbonyl group
Organic nitrogen compound
Amine
Organic oxygen compound
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

hydroxytryptophan (CHEBI:28171 )

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

Protein ID	Protein Name	Protein Type	Uniprot ID	Species

Human Pathways

Pathways

Name	SMPDB/PathBank

Metabolic Reactions

Not Available

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	1	Human ; Human feces; Human feces; pleural fluid plaque; bal; Human stool	Unknown

Exposure Sources

Source Type	Activity	Data Source	Reference
Cosmetics	Not Available	U.S. Environmental Protection Agency	CompTox
Domestics	Not Available	U.S. Environmental Protection Agency	CompTox
Cosmetics	Not Available	U.S. Environmental Protection Agency	CompTox

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

C00001371

Chemspider ID

Not Available

KEGG Compound ID

C01017

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

5-Hydroxytryptophan

METLIN ID

Not Available

PubChem Compound

144

PDB ID

Not Available

ChEBI ID

28171

Food Biomarker Ontology

Not Available

References

Synthesis Reference

Not Available

General References

Sajed T, Marcu A, Ramirez M, Pon A, Guo AC, Knox C, Wilson M, Grant JR, Djoumbou Y, Wishart DS: ECMDB 2.0: A richer resource for understanding the biochemistry of E. coli. Nucleic Acids Res. 2016 Jan 4;44(D1):D495-501. doi: 10.1093/nar/gkv1060. Epub 2015 Oct 19. [PubMed:26481353 ]

Showing metabocard for Aromatic amino acid (MMDBc0031941)

MOL for #<Metabolite:0x00007fdb38749f58>

3D MOL for #<Metabolite:0x00007fdb38749f58>

3D SDF for #<Metabolite:0x00007fdb38749f58>

3D-SDF for #<Metabolite:0x00007fdb38749f58>

PDB for #<Metabolite:0x00007fdb38749f58>

3D PDB for #<Metabolite:0x00007fdb38749f58>

SMILES for #<Metabolite:0x00007fdb38749f58>

INCHI for #<Metabolite:0x00007fdb38749f58>

Structure for #<Metabolite:0x00007fdb38749f58>

3D Structure for #<Metabolite:0x00007fdb38749f58>