CHEBI:190310 - 2-[3-hydroxy-2-methoxy-4-(methoxymethyl)phenyl]-3,4-dihydro-2H-1-benzopyran-3,5,7-triol

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ChEBI Name 2-[3-hydroxy-2-methoxy-4-(methoxymethyl)phenyl]-3,4-dihydro-2H-1-benzopyran-3,5,7-triol
ChEBI ID CHEBI:190310
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H20O7
Net Charge 0
Average Mass 348.351
Monoisotopic Mass 348.12090
InChI InChI=1S/C18H20O7/c1-23-8-9-3-4-11(18(24-2)16(9)22)17-14(21)7-12-13(20)5-10(19)6-15(12)25-17/h3-6,14,17,19-22H,7-8H2,1-2H3
InChIKey RRQKHBPIZLXHIC-UHFFFAOYSA-N
SMILES O1C(C(O)CC=2C1=CC(O)=CC2O)C3=C(OC)C(O)=C(C=C3)COC
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in intestinal content (MEO:0000968). of strain C57BL/6J  [EFO:0000606] See: MetaboLights Study
ChEBI Ontology
Outgoing 2-[3-hydroxy-2-methoxy-4-(methoxymethyl)phenyl]-3,4-dihydro-2H-1-benzopyran-3,5,7-triol (CHEBI:190310) is a ether (CHEBI:25698)
2-[3-hydroxy-2-methoxy-4-(methoxymethyl)phenyl]-3,4-dihydro-2H-1-benzopyran-3,5,7-triol (CHEBI:190310) is a flavonoids (CHEBI:72544)
IUPAC Name
2-[3-hydroxy-2-methoxy-4-(methoxymethyl)phenyl]-3,4-dihydro-2H-chromene-3,5,7-triol
Manual Xrefs Databases
74852052 ChemSpider
HMDB0127865 HMDB
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