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CHEBI:141345 - (R)-3-hydroxybutanenitrile

Default Structure
ChEBI IDCHEBI:141345
ChEBI Name(R)-3-hydroxybutanenitrile
Stars
ASCII Name(R)-3-hydroxybutanenitrile
DefinitionA 3-hydroxybutanenitrile that has R configuration. A metabolite isolated from Aspergillus sp. KJ-9, it is active against a wide variety of phytopathogenic fungi.
Last Modified7 November 2024
SubmitterR. Stephan
DownloadsMolfile
FormulaC4H7NO
Net Charge0
Average Mass85.106
Monoisotopic Mass85.05276
SMILESC[C@@H](O)CC#N
InChIInChI=1S/C4H7NO/c1-4(6)2-3-5/h4,6H,2H2,1H3/t4-/m1/s1
InChIKeyBYJAJQGCMSBKPB-SCSAIBSYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus sp. (ncbitaxon:5065) - PubMed (24708541) Strain: KJ-9
Roles Classification
Biological Roles:
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
ChEBI Ontology
Outgoing Relation(s)
(R)-3-hydroxybutanenitrile (CHEBI:141345) has role antifungal agent (CHEBI:35718)
(R)-3-hydroxybutanenitrile (CHEBI:141345) has role fungal metabolite (CHEBI:76946)
(R)-3-hydroxybutanenitrile (CHEBI:141345) is a 3-hydroxybutanenitrile (CHEBI:142961)
IUPAC Name 
(3R)-3-hydroxybutanenitrile
Synonyms  Source
(−)-3-hydroxybutyronitrileChEBI
(3R)-3-hydroxybutyronitrileChEBI
(R)-3-hydroxybutanonitrileChEBI
(R)-(−)-3-hydroxybutyronitrileChEBI
(R)-3-hydroxybutyronitrileChEBI
(R)-β-hydroxybutyronitrileChEBI
Registry NumbersSources
CAS:125103-95-9PubChem Compound
Citations