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CHEBI:214252 - Orsellide A1

ChEBI IDCHEBI:214252
ChEBI NameOrsellide A1
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H20O8
Net Charge0
Average Mass340.328
Monoisotopic Mass340.11582
SMILESCCO[C@H]1O[C@@H](C)[C@@H](O)C(=O)[C@H]1OC(=O)c1c(C)cc(O)cc1O
InChIInChI=1S/C16H20O8/c1-4-22-16-14(13(20)12(19)8(3)23-16)24-15(21)11-7(2)5-9(17)6-10(11)18/h5-6,8,12,14,16-19H,4H2,1-3H3/t8-,12+,14+,16-/m0/s1
InChIKeyFTDLNCOFPDXPIB-PADWCBLRSA-N
Species of MetaboliteComponentSourceComments
Chaetomium (ncbitaxon:5149) - DOI (10.1007/s10600-015-1196-9)
ChEBI Ontology
Outgoing Relation(s)
Orsellide A1 (CHEBI:214252) is a 4-hydroxybenzoate ester (CHEBI:79323)
IUPAC Name 
[(2S,3S,5R,6S)-2-ethoxy-5-hydroxy-6-methyl-4-oxooxan-3-yl] 2,4-dihydroxy-6-methylbenzoate
Manual XrefsDatabases
78436173ChemSpider