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CHEBI:200842 - Preubetaochromone E

ChEBI IDCHEBI:200842
ChEBI NamePreubetaochromone E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O7
Net Charge0
Average Mass308.286
Monoisotopic Mass308.08960
SMILESCOC(=O)[C@]1(O)[C@@H](O)[C@H](C)[C@H]2Oc3cccc(O)c3C(=O)[C@@H]21
InChIInChI=1S/C15H16O7/c1-6-12-10(15(20,13(6)18)14(19)21-2)11(17)9-7(16)4-3-5-8(9)22-12/h3-6,10,12-13,16,18,20H,1-2H3/t6-,10+,12-,13+,15-/m1/s1
InChIKeyFHOZFIROEVROQO-MSFILTLLSA-N
Species of MetaboliteComponentSourceComments
Preussia africana (ncbitaxon:269684) - PubMed (22324636)
ChEBI Ontology
Outgoing Relation(s)
Preubetaochromone E (CHEBI:200842) is a chromones (CHEBI:23238)
IUPAC Name 
methyl (1R,2S,3S,3aR,9aS)-1,2,8-trihydroxy-3-methyl-9-oxo-2,3,3a,9a-tetrahydrocyclopenta[b]chromene-1-carboxylate
Manual XrefsDatabases
28503673ChemSpider