5-hydroxyindole acetaldehyde (Q27073985)

Hydroxyindoleacetaldehyde (English)

3 October 2016

chemical formula

C₁₀H₉NO₂

1 reference

Hydroxyindoleacetaldehyde (English)

3 October 2016

canonical SMILES

C1=CC2=C(C=C1O)C(=CN2)CC=O

1 reference

Recon 2.2: from reconstruction to model of human metabolism

Hydroxyindoleacetaldehyde (English)

3 October 2016

2 references

stated in

A community-driven global reconstruction of human metabolism.

1 reference

https://reactome.org/PathwayBrowser/#/R-HSA-1430728&DTAB=MT

Identifiers

InChI

InChI=1S/C10H9NO2/c12-4-3-7-6-11-10-2-1-8(13)5-9(7)10/h1-2,4-6,11,13H,3H2

1 reference

Hydroxyindoleacetaldehyde (English)

3 October 2016

2 references

Hydroxyindoleacetaldehyde (English)

3 October 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

1892-21-3

1 reference

https://commonchemistry.cas.org/detail?cas_rn=1892-21-3

9 April 2021

1 reference

Indole-3-acetaldehyde, 5-hydroxy- (English)

3 October 2016

2 references

Hydroxyindoleacetaldehyde (English)

3 October 2016

ChEBI ID

50157

mapping relation type

2 references

(5-hydroxyindol-3-yl)acetaldehyde (English)

3 October 2016

International Chemical Identifier

InChI

InChI=1S/C10H9NO2/c12-4-3-7-6-11-10-2-1-8(13)5-9(7)10/h1-2,4-6,11,13H,3H2

1 reference

2 references

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

DTXCID6094809

0 references

Guide to Pharmacology Ligand ID

6634

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

6634

5-hydroxyindole acetaldehyde (English)

Human Metabolome Database ID

3 October 2016

HMDB0004073

2 references

based on heuristic

inferred from InChIKey

UNII

DAE26MT2UK

1 reference