CHEBI:192521 - Tetrahydroxy-methoxy-flavanone (dihydrorhamnetin) hexoside

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 Tetrahydroxy-methoxy-flavanone (dihydrorhamnetin) hexoside
ChEBI ID CHEBI:192521
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H24O12
Net Charge 0
Average Mass 480.422
Monoisotopic Mass 480.12678
InChI InChI=1S/C22H24O12/c1-31-9-5-12-15(13(6-9)33-22-20(30)18(28)16(26)14(7-23)34-22)17(27)19(29)21(32-12)8-2-3-10(24)11(25)4-8/h2-6,14,16,18-26,28-30H,7H2,1H3/t14-,16-,18+,19?,20-,21?,22-/m1/s1
InChIKey QHEZEIJUHUFOEE-GDYLWFCWSA-N
SMILES O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC=2C3=C(OC(C(O)C3=O)C4=CC(O)=C(O)C=C4)C=C(OC)C2)CO
Metabolite of Species Details
Vitis (NCBI:txid3603) Found in berry (BTO:0000119). See: MetaboLights Study
ChEBI Ontology
Outgoing Tetrahydroxy-methoxy-flavanone (dihydrorhamnetin) hexoside (CHEBI:192521) is a flavonoids (CHEBI:72544)
Tetrahydroxy-methoxy-flavanone (dihydrorhamnetin) hexoside (CHEBI:192521) is a glycoside (CHEBI:24400)
IUPAC Name
2-(3,4-dihydroxyphenyl)-3-hydroxy-7-methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
Manual Xref Database
10306082 ChemSpider
View more database links