CHEBI:211853 - 3-hydroxy-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methyl]-5-methoxy-furan-2-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 3-hydroxy-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methyl]-5-methoxy-furan-2-one
ChEBI ID CHEBI:211853
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H16O6
Net Charge 0
Average Mass 328.320
Monoisotopic Mass 328.09469
InChI InChI=1S/C18H16O6/c1-23-18(10-11-2-6-13(19)7-3-11)15(16(21)17(22)24-18)12-4-8-14(20)9-5-12/h2-9,19-21H,10H2,1H3/t18-/m0/s1
InChIKey NIRMZWVJIJSJIF-SFHVURJKSA-N
SMILES O=C1O[C@@](OC)(CC2=CC=C(O)C=C2)C(=C1O)C3=CC=C(O)C=C3
Metabolite of Species Details
Aspergillus (NCBI:txid5052) See: PubMed
ChEBI Ontology
Outgoing 3-hydroxy-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methyl]-5-methoxy-furan-2-one (CHEBI:211853) is a phenols (CHEBI:33853)
IUPAC Name
3-hydroxy-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methyl]-5-methoxyuran-2-one
Manual Xref Database
34981972 ChemSpider
View more database links