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CHEBI:144367 - 3PO

Default Structure
ChEBI IDCHEBI:144367
ChEBI Name3PO
Stars
DefinitionA member of the class of pyridines that is pyridine substituted by a 3-oxo-3-(pyridin-4-yl)prop-1-en-1-yl group at position 3. An inhibitor of PFKFB3 kinase, an enzyme with a key role in glycolysis.
Last Modified1 August 2019
Submittersabrina, zfin
DownloadsMolfile
FormulaC13H10N2O
Net Charge0
Average Mass210.236
Monoisotopic Mass210.07931
SMILESO=C(/C=C/c1cccnc1)c1ccncc1
InChIInChI=1S/C13H10N2O/c16-13(12-5-8-14-9-6-12)4-3-11-2-1-7-15-10-11/h1-10H/b4-3+
InChIKeyUOWGYMNWMDNSTL-ONEGZZNKSA-N
Roles Classification
Biological Roles:
apoptosis inducer  Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
EC 2.7.1.105 (6-phosphofructo-2-kinase) inhibitor  An EC 2.7.1.* (phosphotransferases with an alcohol group as acceptor) inhibitor that interferes with the action of 6-phosphofructo-2-kinase (EC 2.7.1.105).
autophagy inducer  Any compound that induces the process of autophagy (the self-digestion of one or more components of a cell through the action of enzymes originating within the same cell).
Applications:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
angiogenesis inhibitor  An agent and endogenous substances that antagonize or inhibit the development of new blood vessels.
ChEBI Ontology
Outgoing Relation(s)
3PO (CHEBI:144367) has role angiogenesis inhibitor (CHEBI:48422)
3PO (CHEBI:144367) has role antineoplastic agent (CHEBI:35610)
3PO (CHEBI:144367) has role apoptosis inducer (CHEBI:68495)
3PO (CHEBI:144367) has role autophagy inducer (CHEBI:138880)
3PO (CHEBI:144367) has role EC 2.7.1.105 (6-phosphofructo-2-kinase) inhibitor (CHEBI:144387)
3PO (CHEBI:144367) is a enone (CHEBI:51689)
3PO (CHEBI:144367) is a pyridines (CHEBI:26421)
IUPAC Name 
(2E)-3-(pyridin-3-yl)-1-(pyridin-4-yl)prop-2-en-1-one
Synonyms  Source
(2E)-3-(3-pyridinyl)-1-(4-pyridinyl)-2-propen-1-oneChEBI
3-(3-pyridinyl)-1-(4-pyridinyl)-2-propen-1-oneSUBMITTER
3POSUBMITTER
Registry NumbersSources
CAS:18550-98-6ChEBI
Citations