CHEBI:174129 - 5-Hydroxy-4-methoxy-3-methyl-2,6-canthinedione

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ChEBI Name 5-Hydroxy-4-methoxy-3-methyl-2,6-canthinedione
ChEBI ID CHEBI:174129
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H12N2O4
Net Charge 0
Average Mass 296.282
Monoisotopic Mass 296.07971
InChI InChI=1S/C16H12N2O4/c1-17-11(19)7-9-8-5-3-4-6-10(8)18-12(9)13(17)15(22-2)14(20)16(18)21/h3-7,20H,1-2H3
InChIKey CQFOPDQAOBCODL-UHFFFAOYSA-N
SMILES O(C=1C=2N(C(=O)C=C3C2N(C=4C3=CC=CC4)C(=O)C1O)C)C
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
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ChEBI Ontology
Outgoing 5-Hydroxy-4-methoxy-3-methyl-2,6-canthinedione (CHEBI:174129) is a alkaloid (CHEBI:22315)
5-Hydroxy-4-methoxy-3-methyl-2,6-canthinedione (CHEBI:174129) is a organic heterotetracyclic compound (CHEBI:38163)
IUPAC Name
3-hydroxy-4-methoxy-6-methyl-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-3,5(16),8,10,12,14-hexaene-2,7-dione
Manual Xrefs Databases
30777512 ChemSpider
HMDB0040798 HMDB
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