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Chemical Entities of Biological Interest (ChEBI) is a freely available dictionary of molecular entities focused on ‘small’ chemical compounds.

Adrenochrome (CHEBI:166544) Services Research Training Industry About us ChEBI Examples: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine Advanced Home Advanced Search Browse Documentation Download Tools About ChEBI Submit Contact us DiNA Statistics Entity of the Month Periodic Table Ontology Train online User Manual Annotation Manual Developer Manual FAQ's BiNChE libChEBI Web Services ChEBI > Main CHEBI:166544 - Adrenochrome Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub. ChEBI Name Adrenochrome ChEBI ID CHEBI:166544 Stars This entity has been manually annotated by a third party. Submitter MetaboLights Supplier Information ChemicalBook:CB5725519, eMolecules:534401 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C9H9NO3 Net Charge 0 Average Mass 179.175 Monoisotopic Mass 179.05824 InChI InChI=1S/C9H9NO3/c1-10-4-9(13)5-2-7(11)8(12)3-6(5)10/h2-3,9,13H,4H2,1H3 InChIKey RPHLQSHHTJORHI-UHFFFAOYSA-N SMILES OC1CN(C=2C1=CC(=O)C(=O)C2)C ChEBI Ontology Outgoing Adrenochrome (CHEBI:166544) is a indoles (CHEBI:24828) IUPAC Name 3-hydroxy-1-methyl-2,3-dihydroindole-5,6-dione Manual Xrefs Databases 5687 ChemSpider HMDB0012884 HMDB View more database links Registry Number Type Source 54-06-8 CAS Registry Number ChemIDplus ChEBI is part of the ELIXIR infrastructure This service is an Elixir Core Data Resource. Read more ... News Our impact Contact us Intranet Services By topic By name (A-Z) Help & Support Research Overview Publications Research groups Postdocs & PhDs Training Overview Train at EBI Train outside EBI Train online Contact organisers Industry Overview Members Area Workshops SME Forum Contact Industry programme About us Overview Leadership Funding Background Collaboration Jobs People & groups News Events Visit us Contact us EMBL-EBI, Wellcome Genome Campus, Hinxton, Cambridgeshire, CB10 1SD, UK     +44 (0)1223 49 44 44 Copyright © EMBL-EBI 2018 | EBI is an outstation of the European Molecular Biology Laboratory | Terms of use This website requires cookies, and the limited processing of your personal data in order to function. By using the site you are agreeing to this as outlined in our Privacy Notice and Terms of Use.I agree, dismiss this banner