CHEBI:174739 - 4'-Hydroxy-5,7-dimethoxyflavan

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 4'-Hydroxy-5,7-dimethoxyflavan
ChEBI ID CHEBI:174739
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H18O4
Net Charge 0
Average Mass 286.327
Monoisotopic Mass 286.12051
InChI InChI=1S/C17H18O4/c1-19-13-9-16(20-2)14-7-8-15(21-17(14)10-13)11-3-5-12(18)6-4-11/h3-6,9-10,15,18H,7-8H2,1-2H3
InChIKey AVMGPGZQJKDABF-UHFFFAOYSA-N
SMILES O1C(CCC2=C1C=C(OC)C=C2OC)C3=CC=C(O)C=C3
ChEBI Ontology
Outgoing 4'-Hydroxy-5,7-dimethoxyflavan (CHEBI:174739) is a ether (CHEBI:25698)
4'-Hydroxy-5,7-dimethoxyflavan (CHEBI:174739) is a flavonoids (CHEBI:72544)
IUPAC Name
4-(5,7-dimethoxy-3,4-dihydro-2H-chromen-2-yl)phenol
Manual Xrefs Databases
10290093 ChemSpider
HMDB0030152 HMDB
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