CHEBI:207295 - Eutypellazine J

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ChEBI Name Eutypellazine J
ChEBI ID CHEBI:207295
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C20H22N2O3S2
Net Charge 0
Average Mass 402.530
Monoisotopic Mass 402.10718
InChI InChI=1S/C20H22N2O3S2/c1-26-19(12-14-8-4-3-5-9-14)17(24)22-20(27-2,18(25)21-19)13-15-10-6-7-11-16(15)23/h3-11,23H,12-13H2,1-2H3,(H,21,25)(H,22,24)/t19-,20-/m1/s1
InChIKey ISTWVTSUKTVELB-WOJBJXKFSA-N
SMILES S([C@]1(NC(=O)[C@](SC)(CC2=CC=CC=C2)NC1=O)CC3=C(O)C=CC=C3)C
Metabolite of Species Details
Eutypella (NCBI:txid140192) See: DOI
ChEBI Ontology
Outgoing Eutypellazine J (CHEBI:207295) has functional parent α-amino acid (CHEBI:33704)
Eutypellazine J (CHEBI:207295) is a organonitrogen compound (CHEBI:35352)
Eutypellazine J (CHEBI:207295) is a organooxygen compound (CHEBI:36963)
IUPAC Name
(3R,6R)-3-benzyl-6-[(2-hydroxyphenyl)methyl]-3,6-bis(methylsulanyl)piperazine-2,5-dione
Manual Xref Database
62277935 ChemSpider
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