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CHEBI:208070 - Asperther A

ChEBI IDCHEBI:208070
ChEBI NameAsperther A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H22O8
Net Charge0
Average Mass378.377
Monoisotopic Mass378.13147
SMILESCc1cc(O)cc(Oc2cc(C)c(C(=O)O)c(OC[C@H](O)[C@H](O)CO)c2)c1
InChIInChI=1S/C19H22O8/c1-10-3-12(21)6-13(4-10)27-14-5-11(2)18(19(24)25)17(7-14)26-9-16(23)15(22)8-20/h3-7,15-16,20-23H,8-9H2,1-2H3,(H,24,25)/t15-,16+/m1/s1
InChIKeyQUVXWZKEMUKPDH-CVEARBPZSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (31083492)
ChEBI Ontology
Outgoing Relation(s)
Asperther A (CHEBI:208070) is a aromatic ether (CHEBI:35618)
IUPAC Name 
4-(3-hydroxy-5-methylphenoxy)-2-methyl-6-[(2S,3R)-2,3,4-trihydroxybutoxy]benzoic acid
Manual XrefsDatabases
74849475ChemSpider