CHEBI:215228 - (3S,6R)-6-(para-hydroxybenzyl)-1,4-dimethyl-3,6-bis(methylthio)piperazine-2,5-dione

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ChEBI Name (3S,6R)-6-(para-hydroxybenzyl)-1,4-dimethyl-3,6-bis(methylthio)piperazine-2,5-dione
ChEBI ID CHEBI:215228
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information ZINC000004097885
Download Molfile XML SDF
Formula C15H20N2O3S2
Net Charge 0
Average Mass 340.460
Monoisotopic Mass 340.09153
InChI InChI=1S/C15H20N2O3S2/c1-16-13(21-3)12(19)17(2)15(22-4,14(16)20)9-10-5-7-11(18)8-6-10/h5-8,13,18H,9H2,1-4H3/t13-,15+/m0/s1
InChIKey BBABCVLEKGIJIE-DZGCQCFKSA-N
SMILES S([C@]1(N(C(=O)[C@H](SC)N(C1=O)C)C)CC2=CC=C(O)C=C2)C
Metabolite of Species Details
Trichoderma (NCBI:txid5543) See: DOI
ChEBI Ontology
Outgoing (3S,6R)-6-(para-hydroxybenzyl)-1,4-dimethyl-3,6-bis(methylthio)piperazine-2,5-dione (CHEBI:215228) has functional parent α-amino acid (CHEBI:33704)
(3S,6R)-6-(para-hydroxybenzyl)-1,4-dimethyl-3,6-bis(methylthio)piperazine-2,5-dione (CHEBI:215228) is a organonitrogen compound (CHEBI:35352)
(3S,6R)-6-(para-hydroxybenzyl)-1,4-dimethyl-3,6-bis(methylthio)piperazine-2,5-dione (CHEBI:215228) is a organooxygen compound (CHEBI:36963)
IUPAC Name
(3R,6S)-3-[(4-hydroxyphenyl)methyl]-1,4-dimethyl-3,6-bis(methylsulanyl)piperazine-2,5-dione
Manual Xref Database
71048601 ChemSpider
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