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CHEBI:42080 - BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2-BENZOPYRONE]

Default Structure
ChEBI IDCHEBI:42080
ChEBI NameBISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2-BENZOPYRONE]
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC19H12O6
Net Charge0
Average Mass336.299
Monoisotopic Mass336.06339
SMILES[H]c1c([H])c([H])c2c(c1[H])OC(=O)[C@]([H])(C([H])([H])[C@]1([H])C(=O)Oc3c([H])c([H])c([H])c([H])c3C1=O)C2=O
InChIInChI=1S/C19H12O6/c20-16-10-5-1-3-7-14(10)24-18(22)12(16)9-13-17(21)11-6-2-4-8-15(11)25-19(13)23/h1-8,12-13H,9H2/t12-,13+
InChIKeyHIZKPJUTKKJDGA-BETUJISGSA-N
ChEBI Ontology
Outgoing Relation(s)
BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2-BENZOPYRONE] (CHEBI:42080) is a unclassifieds (CHEBI:27189)
Synonyms  Source
(3R,3'S)-3,3'-methanediylbis(2H-chromene-2,4(3H)-dione)PDBeChem
BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2-BENZOPYRONE]PDBeChem
Manual XrefsDatabases
DTCPDBeChem