CHEBI:226402 - N-acetyl-beta-oxotryptamine

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 N-acetyl-beta-oxotryptamine
ChEBI ID CHEBI:226402
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H12N2O2
Net Charge 0
Average Mass 216.240
Monoisotopic Mass 216.08988
InChI InChI=1S/C12H12N2O2/c1-8(15)13-7-12(16)10-6-14-11-5-3-2-4-9(10)11/h2-6,14H,7H2,1H3,(H,13,15)
InChIKey QYDMJTFKQVPEHJ-UHFFFAOYSA-N
SMILES O=C(C=1C2=C(C=CC=C2)NC1)CNC(=O)C
Metabolite of Species Details
Bacillus pumilus (NCBI:txid1408) See: PubMed
ChEBI Ontology
Outgoing N-acetyl-beta-oxotryptamine (CHEBI:226402) is a indoles (CHEBI:24828)
IUPAC Name
N-[2-(1H-indol-3-yl)-2-oxoethyl]acetamide
Manual Xref Database
3398911 ChemSpider
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