CHEBI:227978 - Halomide

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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 Halomide
ChEBI ID CHEBI:227978
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H22N2O2
Net Charge 0
Average Mass 286.375
Monoisotopic Mass 286.16813
InChI InChI=1S/C17H22N2O2/c1-13(2)15-9-6-10-16(20)19(17(21)11-18-15)12-14-7-4-3-5-8-14/h3-5,7-8,11,13,15H,6,9-10,12H2,1-2H3/t15-/m0/s1
InChIKey QWSNFWAQVYJYLX-HNNXBMFYSA-N
SMILES O=C1N(C(=O)CCC[C@H](N=C1)C(C)C)CC2=CC=CC=C2
Metabolite of Species Details
Bacillus amyloliquefaciens (NCBI:txid1390) See: DOI
ChEBI Ontology
Outgoing Halomide (CHEBI:227978) is a benzenes (CHEBI:22712)
IUPAC Name
1-benzyl-5-propan-2-yl-5,6,7,8-tetrahydro-1,4-diazonine-2,9-dione