CHEBI:183378 - 5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)chroman-4-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)chroman-4-one
ChEBI ID CHEBI:183378
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H14O6
Net Charge 0
Average Mass 302.282
Monoisotopic Mass 302.07904
InChI InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m1/s1
InChIKey AIONOLUJZLIMTK-CQSZACIVSA-N
SMILES O1[C@H](CC(=O)C=2C1=CC(O)=CC2O)C3=CC(O)=C(OC)C=C3
Metabolite of Species Details
Bombus terrestris (NCBI:txid30195) Found in hemolymph (BTO:0000572). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195) Found in brain (BTO:0000142). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195) Found in hindgut (BTO:0000510). See: MetaboLights Study
ChEBI Ontology
Outgoing 5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)chroman-4-one (CHEBI:183378) is a ether (CHEBI:25698)
5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)chroman-4-one (CHEBI:183378) is a flavonoids (CHEBI:72544)
IUPAC Name
(2R)-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydrochromen-4-one
Manual Xref Database
588896 ChemSpider
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