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CHEBI:214229 - 4-dechlorobotrysphone C

ChEBI IDCHEBI:214229
ChEBI Name4-dechlorobotrysphone C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H12O4
Net Charge0
Average Mass172.180
Monoisotopic Mass172.07356
SMILESCCOC1=CC(=O)[C@@H](O)[C@@H](O)C1
InChIInChI=1S/C8H12O4/c1-2-12-5-3-6(9)8(11)7(10)4-5/h3,7-8,10-11H,2,4H2,1H3/t7-,8+/m0/s1
InChIKeyCUKNSTQHIUIZQI-JGVFFNPUSA-N
Species of MetaboliteComponentSourceComments
Neofusicoccum laricinum (ncbitaxon:121618) - PubMed (33069833)
ChEBI Ontology
Outgoing Relation(s)
4-dechlorobotrysphone C (CHEBI:214229) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
(5S,6S)-3-ethoxy-5,6-dihydroxycyclohex-2-en-1-one