CHEBI:205372 - 2096A/B

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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 2096A/B
ChEBI ID CHEBI:205372
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H14N8O4
Net Charge 0
Average Mass 322.285
Monoisotopic Mass 322.11380
InChI InChI=1S/C11H14N8O4/c1-17-6-11(7(21)18(2)10(17)23,15-9(22)19(3)16-6)4-5(20)14-8(12)13-4/h4H,1-3H3,(H,15,22)(H3,12,13,14,20)
InChIKey PZTLBIWVZALOAC-UHFFFAOYSA-N
SMILES O=C1N(C(=O)C2(NC(=O)N(N=C2N1C)C)C3N=C(N)NC3=O)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing 2096A/B (CHEBI:205372) has functional parent α-amino acid (CHEBI:33704)
2096A/B (CHEBI:205372) is a organonitrogen compound (CHEBI:35352)
2096A/B (CHEBI:205372) is a organooxygen compound (CHEBI:36963)
IUPAC Name
4a-(2-amino-5-oxo-1,4-dihydroimidazol-4-yl)-2,6,8-trimethyl-4H-pyrimido[5,4-e][1,2,4]triazine-3,5,7-trione
Manual Xref Database
8120621 ChemSpider
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