CHEBI:214513 - Terezine J

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Terezine J
ChEBI ID CHEBI:214513
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H20N2O6
Net Charge 0
Average Mass 336.344
Monoisotopic Mass 336.13214
InChI InChI=1S/C16H20N2O6/c1-9(2)16(24-4)13(21)17-15(22,14(18-16)23-3)12(20)10-5-7-11(19)8-6-10/h5-9,19,22H,1-4H3,(H,17,21)/t15-,16+/m0/s1
InChIKey QIXVXBWYBJRYIU-JKSUJKDBSA-N
SMILES O=C1N[C@@](O)(C(OC)=N[C@@]1(OC)C(C)C)C(=O)C2=CC=C(O)C=C2
Metabolite of Species Details
Phoma (NCBI:txid37463) See: PubMed
ChEBI Ontology
Outgoing Terezine J (CHEBI:214513) is a aromatic ketone (CHEBI:76224)
IUPAC Name
(3R,6R)-6-hydroxy-6-(4-hydroxybenzoyl)-3,5-dimethoxy-3-propan-2-yl-1H-pyrazin-2-one
Manual Xref Database
78442131 ChemSpider
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