MiMeDB: Showing metabocard for 5,6-Dihydroxyindole (MMDBc0048016)

Microbial

Human

Record Information

Version

1.0

Status

Detected and Quantified

Creation Date

2022-04-19 21:49:46 UTC

Update Date

2025-09-17 19:36:29 UTC

Metabolite ID

MMDBc0048016

Metabolite Identification

Common Name

5,6-Dihydroxyindole

Description

5,6-Dihydroxyindole is a substrate for Tyrosinase.

Structure

MOL SDF PDB SMILES InChI

Synonyms

Value	Source
DHI	ChEBI
Dopamine lutine	ChEBI
5,6-Dihydroxyindole	HMDB
Indole-5,6-diol	HMDB
Indolylquinol	HMDB

Molecular Formula

C₈H₇NO₂

Average Mass

149.1467

Monoisotopic Mass

149.047678473

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C8H7NO2/c10-7-3-5-1-2-9-6(5)4-8(7)11/h1-4,9-11H

InChI Key

SGNZYJXNUURYCH-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as hydroxyindoles. These are organic compounds containing an indole moiety that carries a hydroxyl group.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Indoles and derivatives

Sub Class

Hydroxyindoles

Direct Parent

Hydroxyindoles

Alternative Parents

Substituents

Hydroxyindole
Indole
1-hydroxy-2-unsubstituted benzenoid
Benzenoid
Heteroaromatic compound
Pyrrole
Azacycle
Organic nitrogen compound
Organic oxygen compound
Organopnictogen compound
Hydrocarbon derivative
Organooxygen compound
Organonitrogen compound
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

dihydroxyindole (CHEBI:27404 )
a small molecule (DIHYDROXYINDOLE )

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

Feces

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

This table shows at most 5 pathways. For the full list of associated pathways:

See All Associated Bacterial Pathways

Name	SMPDB/PathBank

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
Parkinson's disease	increased	Association	Human urine	PubMed	25271123

Microbial Sources

Superkingdom/Kingdom	Phylum	Total species	Hosts and Body Sites	Microbial Links

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 Feces	Detected but not Quantified									HMDB

External Links

HMDB ID

HMDB0004058

DrugBank ID

DB01811

Phenol Explorer Compound ID

Not Available

FooDB ID

FDB023293

KNApSAcK ID

Not Available

Chemspider ID

102690

KEGG Compound ID

C05578

BioCyc ID

DIHYDROXYINDOLE

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

7009

PubChem Compound

114683

PDB ID

Not Available

ChEBI ID

27404

Food Biomarker Ontology

Not Available

References

Synthesis Reference

Not Available

General References

Pavel S: A new possible pathogenesis of some gallstones. Med Hypotheses. 1984 Jul;14(3):285-92. doi: 10.1016/0306-9877(87)90130-7. [PubMed:6472156 ]
Pavel S, Boverhof R, Wolthers BG: Identification of 5-hydroxy-6-indolyl-O-sulfate in urine of patients with malignant melanoma. J Invest Dermatol. 1984 Jun;82(6):577-9. doi: 10.1111/1523-1747.ep12261318. [PubMed:6547157 ]
Pavel S, Muskiet FA: Eumelanin (precursor) metabolites as markers for pigmented malignant melanoma: a preliminary report. Cancer Detect Prev. 1983;6(1-2):311-6. [PubMed:6883388 ]
Brunk E, Sahoo S, Zielinski DC, Altunkaya A, Drager A, Mih N, Gatto F, Nilsson A, Preciat Gonzalez GA, Aurich MK, Prlic A, Sastry A, Danielsdottir AD, Heinken A, Noronha A, Rose PW, Burley SK, Fleming RMT, Nielsen J, Thiele I, Palsson BO: Recon3D enables a three-dimensional view of gene variation in human metabolism. Nat Biotechnol. 2018 Mar;36(3):272-281. doi: 10.1038/nbt.4072. Epub 2018 Feb 19. [PubMed:29457794 ]

Showing metabocard for 5,6-Dihydroxyindole (MMDBc0048016)

MOL for #<Metabolite:0x00007ff80d6c9230>

3D MOL for #<Metabolite:0x00007ff80d6c9230>

3D SDF for #<Metabolite:0x00007ff80d6c9230>

3D-SDF for #<Metabolite:0x00007ff80d6c9230>

PDB for #<Metabolite:0x00007ff80d6c9230>

3D PDB for #<Metabolite:0x00007ff80d6c9230>

SMILES for #<Metabolite:0x00007ff80d6c9230>

INCHI for #<Metabolite:0x00007ff80d6c9230>

Structure for #<Metabolite:0x00007ff80d6c9230>

3D Structure for #<Metabolite:0x00007ff80d6c9230>