CHEBI:228737 - 3-(methylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole

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ChEBI Name 3-(methylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole
ChEBI ID CHEBI:228737
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H8N4S
Net Charge 0
Average Mass 216.260
Monoisotopic Mass 216.04697
InChI InChI=1S/C10H8N4S/c1-15-10-12-9-8(13-14-10)6-4-2-3-5-7(6)11-9/h2-5H,1H3,(H,11,12,14)
InChIKey CTOXAONEYODXLL-UHFFFAOYSA-N
SMILES S(C1=NC=2NC=3C(C2N=N1)=CC=CC3)C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: MetaboLights Study
ChEBI Ontology
Outgoing 3-(methylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole (CHEBI:228737) is a indoles (CHEBI:24828)
IUPAC Name
3-methylsulanyl-5H-[1,2,4]triazino[5,6-b]indole
Manual Xref Database
4525483 ChemSpider
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