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CHEBI:132857 - viscumneoside III

ChEBI IDCHEBI:132857
ChEBI Nameviscumneoside III
Stars
DefinitionA viscumneoside that is homoeriodictyol in which the hydroxy group at position 7 has been converted into the corresponding β-D-glucopyranoside, the 2-hydroxy group of which has been converted to its β-D-apiofuranoside derivative. Found in Viscum coloratum, an evergreen hemiparasitic plant whose stems and leaves are used in traditional Chinese medicine for the treatment of rheumatism.
Last Modified28 April 2020
Submitterliuqingping
DownloadsMolfile
FormulaC27H32O15
Net Charge0
Average Mass596.538
Monoisotopic Mass596.17412
SMILES[H][C@]1(O)[C@H](O[C@H]2[C@H](Oc3cc(O)c4c(c3)O[C@H](c3ccc(O)c(OC)c3)CC4=O)O[C@H](CO)[C@@H](O)[C@@H]2O)OC[C@]1(O)CO
InChIInChI=1S/C27H32O15/c1-37-17-4-11(2-3-13(17)30)16-7-15(32)20-14(31)5-12(6-18(20)40-16)39-25-23(22(34)21(33)19(8-28)41-25)42-26-24(35)27(36,9-29)10-38-26/h2-6,16,19,21-26,28-31,33-36H,7-10H2,1H3/t16-,19+,21+,22-,23+,24-,25+,26-,27+/m0/s1
InChIKeyBYALYZGUSBVZQP-XJBIVIJWSA-N
Species of MetaboliteComponentSourceComments
Viscum coloratum (ncbitaxon:159976) aerial part (BTO:0001658) PubMed (21922656) From stems & leaves
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
viscumneoside III (CHEBI:132857) has functional parent homoeriodictyol (CHEBI:74960)
viscumneoside III (CHEBI:132857) has functional parent β-D-apiose (CHEBI:27672)
viscumneoside III (CHEBI:132857) has role plant metabolite (CHEBI:76924)
viscumneoside III (CHEBI:132857) is a flavanone glycoside (CHEBI:72730)
viscumneoside III (CHEBI:132857) is a viscumneoside (CHEBI:133718)
viscumneoside III (CHEBI:132857) is a β-D-glucoside (CHEBI:22798)
Incoming Relation(s)
viscumneoside V (CHEBI:132859) has functional parent viscumneoside III (CHEBI:132857)
IUPAC Name 
(2S)-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-3,4-dihydro-2H-chromen-7-yl 2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]-β-D-glucopyranoside
Synonyms  Source
(2S)-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-3,4-dihydro-2H-chromen-7-yl 2-O-β-D-apiofuranosyl-β-D-glucopyranosideChEBI
homoeriodictyol-7-O-β-D-apiosyl-(1→2)-β-D-glucopyranosideChEBI
Manual XrefsDatabases
LMPK12140434LIPID MAPS
C00008430KNApSAcK
Registry NumbersSources
CAS:118985-27-6ChemIDplus
Citations