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CHEBI:233845 - 2-acetyl-4(5)-tetrahydroxybutyl imidazole

Default Structure
ChEBI IDCHEBI:233845
ChEBI Name2-acetyl-4(5)-tetrahydroxybutyl imidazole
Stars
SubmitterFlyBase
DownloadsMolfile
FormulaC9H14N2O5
Net Charge0
Average Mass230.220
Monoisotopic Mass230.09027
SMILES[H][C@@](O)([C@]([H])(O)CO)[C@]([H])(O)c1cnc(C(C)=O)n1
InChIInChI=1S/C9H14N2O5/c1-4(13)9-10-2-5(11-9)7(15)8(16)6(14)3-12/h2,6-8,12,14-16H,3H2,1H3,(H,10,11)/t6-,7-,8-/m1/s1
InChIKeyCQSIXFHVGKMLGQ-BWZBUEFSSA-N
Roles Classification
Biological Roles:
EC 4.1.2.27 (sphinganine-1-phosphate aldolase) inhibitor  An EC 4.1.2.* (aldehyde-lyase) inhibitor that interferes with the action of sphinganine-1-phosphate aldolase (EC 4.1.2.27).
immunosuppressive agent  An agent that suppresses immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-cells or by inhibiting the activation of helper cells. In addition, an immunosuppressive agent is a role played by a compound which is exhibited by a capability to diminish the extent and/or voracity of an immune response.
Application:
immunosuppressive agent  An agent that suppresses immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-cells or by inhibiting the activation of helper cells. In addition, an immunosuppressive agent is a role played by a compound which is exhibited by a capability to diminish the extent and/or voracity of an immune response.
ChEBI Ontology
Outgoing Relation(s)
2-acetyl-4(5)-tetrahydroxybutyl imidazole (CHEBI:233845) has role EC 4.1.2.27 (sphinganine-1-phosphate aldolase) inhibitor (CHEBI:83034)
2-acetyl-4(5)-tetrahydroxybutyl imidazole (CHEBI:233845) has role immunosuppressive agent (CHEBI:35705)
2-acetyl-4(5)-tetrahydroxybutyl imidazole (CHEBI:233845) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
1-[5-[(1R,2S,3R)-1,2,3,4-tetrahydroxybutyl]-1H-imidazol-2-yl]ethanone
Synonym  Source
THISUBMITTER
Registry NumbersSources
CAS:94944-70-4SUBMITTER
Citations