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CHEBI:87123 - tulipalin B

Default Structure
ChEBI IDCHEBI:87123
ChEBI Nametulipalin B
Stars
DefinitionA member of the class of butan-4-olides that is 3-methylidenebutan-4-olide carrying an additional hydroxy substituent at position 4 (the 4R-enantiomer)
Last Modified11 August 2015
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC5H6O3
Net Charge0
Average Mass114.100
Monoisotopic Mass114.03169
SMILESC=C1C(=O)OC[C@@H]1O
InChIInChI=1S/C5H6O3/c1-3-4(6)2-8-5(3)7/h4,6H,1-2H2/t4-/m0/s1
InChIKeyBFLSLERVRLOFCX-BYPYZUCNSA-N
Species of MetaboliteComponentSourceComments
Tulipa gesneriana (ncbitaxon:13306) - PubMed (25126881)
Roles Classification
Biological Roles:
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
antibacterial agent  A substance (or active part thereof) that kills or slows the growth of bacteria.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
tulipalin B (CHEBI:87123) has role antibacterial agent (CHEBI:33282)
tulipalin B (CHEBI:87123) has role antifungal agent (CHEBI:35718)
tulipalin B (CHEBI:87123) has role plant metabolite (CHEBI:76924)
tulipalin B (CHEBI:87123) is a butan-4-olide (CHEBI:22950)
tulipalin B (CHEBI:87123) is a enoate ester (CHEBI:51702)
tulipalin B (CHEBI:87123) is a secondary alcohol (CHEBI:35681)
IUPAC Name 
(4R)-4-hydroxy-3-methylideneoxolan-2-one
Synonyms  Source
2-methylene-3-hydroxy-γ-butyrolactoneChEBI
(+)-Tulipalin BKNApSAcK
α-methylene-β-hydroxy-γ-butyrolactoneChEBI
UniProt Name  Source
tulipalin BUniProt
Manual XrefsDatabases
C00036320KNApSAcK
CPD-18287MetaCyc
Registry NumbersSources
CAS:95529-89-8KNApSAcK
Citations