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CHEBI:80492 - naringin chalcone

ChEBI IDCHEBI:80492
ChEBI Namenaringin chalcone
Stars
DefinitionA disaccharide derivative that is trans-chalcone substituted by hydroxy groups at positions 4, 2' and 6' and a 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyloxy group at position 4' respectively.
Last Modified9 June 2015
DownloadsMolfile
FormulaC27H32O14
Net Charge0
Average Mass580.539
Monoisotopic Mass580.17921
SMILESC[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c(C(=O)/C=C/c4ccc(O)cc4)c(O)c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C27H32O14/c1-11-20(33)22(35)24(37)26(38-11)41-25-23(36)21(34)18(10-28)40-27(25)39-14-8-16(31)19(17(32)9-14)15(30)7-4-12-2-5-13(29)6-3-12/h2-9,11,18,20-29,31-37H,10H2,1H3/b7-4+/t11-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1
InChIKeyIXVXIWLKOMVSFY-GOZPEMRWSA-N
ChEBI Ontology
Outgoing Relation(s)
naringin chalcone (CHEBI:80492) has functional parent trans-chalcone (CHEBI:48965)
naringin chalcone (CHEBI:80492) is a chalcones (CHEBI:23086)
naringin chalcone (CHEBI:80492) is a disaccharide derivative (CHEBI:63353)
naringin chalcone (CHEBI:80492) is a resorcinols (CHEBI:33572)
IUPAC Name 
3,5-dihydroxy-4-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]phenyl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside
Synonym  Source
4'-rhamnoglucosyloxy-2',4,6'-trihydroxychalconeChEBI
Manual XrefsDatabases
C16423KEGG COMPOUND
Registry NumbersSources
Reaxys:73503Reaxys