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CHEBI:202284 - Sargabetaopenilline A

ChEBI IDCHEBI:202284
ChEBI NameSargabetaopenilline A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O6
Net Charge0
Average Mass296.319
Monoisotopic Mass296.12599
SMILESCc1c(O)cc2c(c1O)CO[C@@]1(O[C@@H](C)CC[C@@H]1O)[C@@H]2O
InChIInChI=1S/C15H20O6/c1-7-3-4-12(17)15(21-7)14(19)9-5-11(16)8(2)13(18)10(9)6-20-15/h5,7,12,14,16-19H,3-4,6H2,1-2H3/t7-,12-,14+,15-/m0/s1
InChIKeyFGZYTFOTBIVDDG-NKCGPBARSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (25501795)
ChEBI Ontology
Outgoing Relation(s)
Sargabetaopenilline A (CHEBI:202284) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
(3S,3'S,4R,6'S)-6',7-dimethylspiro[1,4-dihydroisochromene-3,2'-oxane]-3',4,6,8-tetrol
Manual XrefsDatabases
34981843ChemSpider