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CHEBI:224807 - Lachnone E

ChEBI IDCHEBI:224807
ChEBI NameLachnone E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H20O8
Net Charge0
Average Mass364.350
Monoisotopic Mass364.11582
SMILESCC(=O)C[C@]1(O)C(=O)c2c(O)cc(CO)cc2O[C@@]1(C)[C@@H]1CCC(=O)O1
InChIInChI=1S/C18H20O8/c1-9(20)7-18(24)16(23)15-11(21)5-10(8-19)6-12(15)26-17(18,2)13-3-4-14(22)25-13/h5-6,13,19,21,24H,3-4,7-8H2,1-2H3/t13-,17-,18-/m0/s1
InChIKeyHOIRMAMFSJXDHK-KKXDTOCCSA-N
Species of MetaboliteComponentSourceComments
Lachnum (ncbitaxon:47817) - PubMed (16792425)
ChEBI Ontology
Outgoing Relation(s)
Lachnone E (CHEBI:224807) is a chromones (CHEBI:23238)
IUPAC Name 
(2S,3R)-3,5-dihydroxy-7-(hydroxymethyl)-2-methyl-2-[(2S)-5-oxooxolan-2-yl]-3-(2-oxopropyl)chromen-4-one
Manual XrefsDatabases
9698207ChemSpider