CHEBI:204108 - 3-(3-hydroxy-4-methoxybenzyl)-6-isobutyl-2,5-diketopiperazine

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ChEBI Name 3-(3-hydroxy-4-methoxybenzyl)-6-isobutyl-2,5-diketopiperazine
ChEBI ID CHEBI:204108
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C16H22N2O4
Net Charge 0
Average Mass 306.362
Monoisotopic Mass 306.15796
InChI InChI=1S/C16H22N2O4/c1-9(2)6-11-15(20)18-12(16(21)17-11)7-10-4-5-14(22-3)13(19)8-10/h4-5,8-9,11-12,19H,6-7H2,1-3H3,(H,17,21)(H,18,20)/t11-,12-/m1/s1
InChIKey UAAHEUFOBRJXPN-VXGBXAGGSA-N
SMILES O=C1N[C@@H](C(=O)N[C@@H]1CC2=CC(O)=C(OC)C=C2)CC(C)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing 3-(3-hydroxy-4-methoxybenzyl)-6-isobutyl-2,5-diketopiperazine (CHEBI:204108) is a methoxybenzenes (CHEBI:51683)
3-(3-hydroxy-4-methoxybenzyl)-6-isobutyl-2,5-diketopiperazine (CHEBI:204108) is a phenols (CHEBI:33853)
IUPAC Name
(3R,6R)-3-[(3-hydroxy-4-methoxyphenyl)methyl]-6-(2-methylpropyl)piperazine-2,5-dione
Manual Xref Database
58196950 ChemSpider
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