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CHEBI:207771 - Botrysphone B

ChEBI IDCHEBI:207771
ChEBI NameBotrysphone B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H12O5
Net Charge0
Average Mass188.179
Monoisotopic Mass188.06847
SMILESCOC1=CC(=O)[C@H](O)[C@H](O)[C@@H]1OC
InChIInChI=1S/C8H12O5/c1-12-5-3-4(9)6(10)7(11)8(5)13-2/h3,6-8,10-11H,1-2H3/t6-,7-,8+/m0/s1
InChIKeyGSEPZJXCVYXWKJ-BIIVOSGPSA-N
Species of MetaboliteComponentSourceComments
Neofusicoccum laricinum (ncbitaxon:121618) - PubMed (28609099)
ChEBI Ontology
Outgoing Relation(s)
Botrysphone B (CHEBI:207771) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
(4S,5S,6R)-5,6-dihydroxy-3,4-dimethoxycyclohex-2-en-1-one
Manual XrefsDatabases
78441645ChemSpider