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CHEBI:209849 - Banksialactone H

ChEBI IDCHEBI:209849
ChEBI NameBanksialactone H
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H26O9
Net Charge0
Average Mass446.452
Monoisotopic Mass446.15768
SMILESCOc1cc(O)c2c(c1C)[C@H](C)C(O)(COC(=O)c1c(C)c(C)c(O)c(C)c1O)OC2=O
InChIInChI=1S/C23H26O9/c1-9-10(2)19(25)12(4)20(26)17(9)21(27)31-8-23(29)13(5)16-11(3)15(30-6)7-14(24)18(16)22(28)32-23/h7,13,24-26,29H,8H2,1-6H3/t13-,23?/m0/s1
InChIKeyLAONCLCOCCMFGL-AVEISGIFSA-N
Species of MetaboliteComponentSourceComments
Aspergillus banksianus (ncbitaxon:2175282) - PubMed (29920099)
ChEBI Ontology
Outgoing Relation(s)
Banksialactone H (CHEBI:209849) is a 4-hydroxybenzoate ester (CHEBI:79323)
IUPAC Name 
[(4S)-3,8-dihydroxy-6-methoxy-4,5-dimethyl-1-oxo-4H-isochromen-3-yl]methyl 2,4-dihydroxy-3,5,6-trimethylbenzoate
Manual XrefsDatabases
78439100ChemSpider