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CHEBI:198784 - Terezine B

ChEBI IDCHEBI:198784
ChEBI NameTerezine B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H22N2O5
Net Charge0
Average Mass322.361
Monoisotopic Mass322.15287
SMILESCOC1=N[C@](OC)(C(C)C)C(=O)N[C@@]1(O)[C@H](O)c1ccccc1
InChIInChI=1S/C16H22N2O5/c1-10(2)16(23-4)13(20)17-15(21,14(18-16)22-3)12(19)11-8-6-5-7-9-11/h5-10,12,19,21H,1-4H3,(H,17,20)/t12-,15-,16+/m1/s1
InChIKeyGOQWKAOJTXJMMW-WQVCFCJDSA-N
Species of MetaboliteComponentSourceComments
Sporormiella (ncbitaxon:718228) - DOI (10.1021/np50115a011)
ChEBI Ontology
Outgoing Relation(s)
Terezine B (CHEBI:198784) has functional parent α-amino acid (CHEBI:33704)
Terezine B (CHEBI:198784) is a organonitrogen compound (CHEBI:35352)
Terezine B (CHEBI:198784) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(3S,6R)-6-hydroxy-6-[(R)-hydroxy(phenyl)methyl]-3,5-dimethoxy-3-propan-2-yl-1H-pyrazin-2-one
Manual XrefsDatabases
9898349ChemSpider