CHEBI:201183 - 3-[(2S,5S)-5-(2-methylpropyl)-3,6-dioxopiperazin-2-yl]-N-(2-phenylethyl)propanamide

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ChEBI Name 3-[(2S,5S)-5-(2-methylpropyl)-3,6-dioxopiperazin-2-yl]-N-(2-phenylethyl)propanamide
ChEBI ID CHEBI:201183
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H27N3O3
Net Charge 0
Average Mass 345.443
Monoisotopic Mass 345.20524
InChI InChI=1S/C19H27N3O3/c1-13(2)12-16-19(25)21-15(18(24)22-16)8-9-17(23)20-11-10-14-6-4-3-5-7-14/h3-7,13,15-16H,8-12H2,1-2H3,(H,20,23)(H,21,25)(H,22,24)/t15-,16-/m0/s1
InChIKey HENGXXJBCZKGME-HOTGVXAUSA-N
SMILES O=C1N[C@H](C(=O)N[C@H]1CC(C)C)CCC(=O)NCCC2=CC=CC=C2
Metabolite of Species Details
Arenibacter (NCBI:txid178469) See: PubMed
ChEBI Ontology
Outgoing 3-[(2S,5S)-5-(2-methylpropyl)-3,6-dioxopiperazin-2-yl]-N-(2-phenylethyl)propanamide (CHEBI:201183) has functional parent α-amino acid (CHEBI:33704)
3-[(2S,5S)-5-(2-methylpropyl)-3,6-dioxopiperazin-2-yl]-N-(2-phenylethyl)propanamide (CHEBI:201183) is a organonitrogen compound (CHEBI:35352)
3-[(2S,5S)-5-(2-methylpropyl)-3,6-dioxopiperazin-2-yl]-N-(2-phenylethyl)propanamide (CHEBI:201183) is a organooxygen compound (CHEBI:36963)
IUPAC Name
3-[(2S,5S)-5-(2-methylpropyl)-3,6-dioxopiperazin-2-yl]-N-(2-phenylethyl)propanamide
Manual Xref Database
78436733 ChemSpider
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