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CHEBI:69965 - Metasequirin E

ChEBI IDCHEBI:69965
ChEBI NameMetasequirin E
Stars
DefinitionA natural product found in Metasequoia glyptostroboides.
Last Modified22 September 2014
DownloadsMolfile
FormulaC19H22O7
Net Charge0
Average Mass362.378
Monoisotopic Mass362.13655
SMILES[H][C@]1([C@H](O)c2ccc(O)c(OC)c2)OC[C@@H](O)[C@H]1c1ccc(O)c(OC)c1
InChIInChI=1S/C19H22O7/c1-24-15-7-10(3-5-12(15)20)17-14(22)9-26-19(17)18(23)11-4-6-13(21)16(8-11)25-2/h3-8,14,17-23H,9H2,1-2H3/t14-,17-,18-,19+/m1/s1
InChIKeyVMDUTECRPCIIII-AXUOBQJMSA-N
Species of MetaboliteComponentSourceComments
Metasequoia glyptostroboides (ncbitaxon:3371)
leaf (BTO:0000713) PubMed (21226514) 95% ethanolic extract of air-dried, powdered stems and leaves
stem (BTO:0001300) PubMed (21226514) 95% ethanolic extract of air-dried, powdered stems and leaves
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Metasequirin E (CHEBI:69965) has role metabolite (CHEBI:25212)
Metasequirin E (CHEBI:69965) is a methoxybenzenes (CHEBI:51683)
Metasequirin E (CHEBI:69965) is a phenols (CHEBI:33853)
Synonyms  Source
(1R)-2,5-Anhydro-3-deoxy-3-(4-hydroxy-3-methoxyphenyl)-1-C-(4-hydroxy-3-methoxyphenyl)-D-arabinitolChEBI
(3S,4R,5S)-5-[(R)-hydroxy-(4-hydroxy-3-methoxyphenyl)methyl]-4-(4-hydroxy-3-methoxyphenyl)oxolan-3-olChEBI
Citations