CHEBI:139455 - 1,5-anhydro-1-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-6-yl]hexitol

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ChEBI Name 1,5-anhydro-1-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-6-yl]hexitol
ChEBI ID CHEBI:139455
ChEBI ASCII Name 1,5-anhydro-1-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-6-yl]hexitol
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H20O11
Net Charge 0
Average Mass 448.378
Monoisotopic Mass 448.10056
InChI InChI=1S/C21H20O11/c22-6-14-17(27)19(29)20(30)21(32-14)16-11(26)5-13-15(18(16)28)10(25)4-12(31-13)7-1-2-8(23)9(24)3-7/h1-5,14,17,19-24,26-30H,6H2
InChIKey ODBRNZZJSYPIDI-UHFFFAOYSA-N
SMILES O1C(C(O)C(O)C(O)C1CO)C2=C(O)C3=C(OC(=CC3=O)C4=CC(O)=C(O)C=C4)C=C2O
ChEBI Ontology
Outgoing 1,5-anhydro-1-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-6-yl]hexitol (CHEBI:139455) is a C-glycosyl compound (CHEBI:20857)
1,5-anhydro-1-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-6-yl]hexitol (CHEBI:139455) is a flavonoids (CHEBI:72544)
Manual Xrefs Databases
4932280 ChemSpider
HMDB0127356 HMDB
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Last Modified
16 January 2018