CHEBI:174180 - (1R,2S,3R)-2-Acetyl-4(5)-(1,2,3,4-tetrahydroxybutyl)imidazole

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ChEBI Name (1R,2S,3R)-2-Acetyl-4(5)-(1,2,3,4-tetrahydroxybutyl)imidazole
ChEBI ID CHEBI:174180
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C9H14N2O5
Net Charge 0
Average Mass 230.220
Monoisotopic Mass 230.09027
InChI InChI=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)
InChIKey CQSIXFHVGKMLGQ-UHFFFAOYSA-N
SMILES OC(C(O)C=1NC(=NC1)C(=O)C)C(O)CO
ChEBI Ontology
Outgoing (1R,2S,3R)-2-Acetyl-4(5)-(1,2,3,4-tetrahydroxybutyl)imidazole (CHEBI:174180) is a aromatic ketone (CHEBI:76224)
IUPAC Name
1-[5-(1,2,3,4-tetrahydroxybutyl)-1H-imidazol-2-yl]ethanone
Manual Xrefs Databases
157173 ChemSpider
HMDB0029756 HMDB
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Registry Number Type Source
95120-07-3 CAS Registry Number ChemIDplus