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CHEBI:78887 - tirapazamine

ChEBI IDCHEBI:78887
ChEBI Nametirapazamine
Stars
DefinitionA member of the class of benzotriazines that is 1,2,4-benzotriazine carrying an amino substituent at position 3 and two oxido substituents at positions 1 and 4.
Last Modified18 June 2014
SubmitterSteve
DownloadsMolfile
FormulaC7H6N4O2
Net Charge0
Average Mass178.151
Monoisotopic Mass178.04908
SMILESNc1n[n+]([O-])c2ccccc2[n+]1[O-]
InChIInChI=1S/C7H6N4O2/c8-7-9-11(13)6-4-2-1-3-5(6)10(7)12/h1-4H,(H2,8,9)
InChIKeyORYDPOVDJJZGHQ-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
apoptosis inducer  Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
antibacterial agent  A substance (or active part thereof) that kills or slows the growth of bacteria.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
tirapazamine (CHEBI:78887) has functional parent 1,2,4-benzotriazine (CHEBI:38011)
tirapazamine (CHEBI:78887) has role antibacterial agent (CHEBI:33282)
tirapazamine (CHEBI:78887) has role antineoplastic agent (CHEBI:35610)
tirapazamine (CHEBI:78887) has role apoptosis inducer (CHEBI:68495)
tirapazamine (CHEBI:78887) is a N-oxide (CHEBI:35580)
tirapazamine (CHEBI:78887) is a aromatic amine (CHEBI:33860)
tirapazamine (CHEBI:78887) is a benzotriazines (CHEBI:51361)
IUPAC Name 
1,2,4-benzotriazin-3-amine 1,4-dioxide
INN  Source
tirapazamineKEGG DRUG
Synonyms  Source
3-Amino-1,2,4-benzotriazine 1,4-dioxideChemIDplus
SR-4233ChEBI
SR 4233ChemIDplus
Manual XrefsDatabases
D06167KEGG DRUG
TirapazamineWikipedia
Registry NumbersSources
Reaxys:179322Reaxys
CAS:27314-97-2KEGG DRUG
CAS:27314-97-2ChemIDplus
Citations