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CHEBI:81986 - Dikegulac

ChEBI IDCHEBI:81986
ChEBI NameDikegulac
Stars
DownloadsMolfile
FormulaC12H18O7
Net Charge0
Average Mass274.269
Monoisotopic Mass274.10525
SMILES[H][C@@]12OC(C)(C)OC[C@]1([H])O[C@@]1(C(=O)O)OC(C)(C)O[C@]12[H]
InChIInChI=1S/C12H18O7/c1-10(2)15-5-6-7(17-10)8-12(16-6,9(13)14)19-11(3,4)18-8/h6-8H,5H2,1-4H3,(H,13,14)/t6-,7+,8-,12+/m0/s1
InChIKeyFWCBATIDXGJRMF-FLNNQWSLSA-N
ChEBI Ontology
Outgoing Relation(s)
Dikegulac (CHEBI:81986) is a dioxanes (CHEBI:46926)
Synonym  Source
Diprogulic acidKEGG COMPOUND
Manual XrefsDatabases
C18825KEGG COMPOUND
1113PPDB
Registry NumbersSources
CAS:18467-77-1KEGG COMPOUND