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CHEBI:189451 - Vitexin rhamnoside

ChEBI IDCHEBI:189451
ChEBI NameVitexin rhamnoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H30O14
Net Charge0
Average Mass578.523
Monoisotopic Mass578.16356
SMILES[H][C@@]1(c2c(O)cc(O)c3c(=O)cc(-c4ccc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc4)oc23)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C27H30O14/c1-9-19(32)21(34)24(37)27(38-9)39-11-4-2-10(3-5-11)15-7-14(31)17-12(29)6-13(30)18(25(17)40-15)26-23(36)22(35)20(33)16(8-28)41-26/h2-7,9,16,19-24,26-30,32-37H,8H2,1H3/t9-,16+,19-,20+,21+,22-,23+,24+,26-,27-/m0/s1
InChIKeyZIIBNXKQZAUBRD-VVZHCWMZSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) leaf sheath (BTO:0005094) MetaboLights (MTBLS3518)
ChEBI Ontology
Outgoing Relation(s)
Vitexin rhamnoside (CHEBI:189451) is a flavonoids (CHEBI:72544)
Vitexin rhamnoside (CHEBI:189451) is a glycoside (CHEBI:24400)
IUPAC Name 
5,7-dihydroxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-[4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]chromen-4-one
Manual XrefsDatabases
4590019ChemSpider
Registry NumbersSources
CAS:32426-34-9ChemIDplus