CHEBI:166923 - (3S)-7-Hydroxy-2',3',4',5',8-pentamethoxyisoflavan

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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 (3S)-7-Hydroxy-2',3',4',5',8-pentamethoxyisoflavan
ChEBI ID CHEBI:166923
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H24O7
Net Charge 0
Average Mass 376.405
Monoisotopic Mass 376.15220
InChI InChI=1S/C20H24O7/c1-22-15-9-13(17(23-2)20(26-5)19(15)25-4)12-8-11-6-7-14(21)18(24-3)16(11)27-10-12/h6-7,9,12,21H,8,10H2,1-5H3/t12-/m1/s1
InChIKey HXMFOQRLTFPKOD-GFCCVEGCSA-N
SMILES O1C[C@@](CC2=C1C(OC)=C(O)C=C2)(C=3C(OC)=C(OC)C(OC)=C(OC)C3)[H]
ChEBI Ontology
Outgoing (3S)-7-Hydroxy-2',3',4',5',8-pentamethoxyisoflavan (CHEBI:166923) is a ether (CHEBI:25698)
(3S)-7-Hydroxy-2',3',4',5',8-pentamethoxyisoflavan (CHEBI:166923) is a flavonoids (CHEBI:72544)
IUPAC Name
(3S)-8-methoxy-3-(2,3,4,5-tetramethoxyphenyl)-3,4-dihydro-2H-chromen-7-ol
Manual Xrefs Databases
414276 ChemSpider
LMPK12080001 LIPID MAPS
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