CHEBI:189462 - isorhamnetin-3-O-nehesperidine

ChEBI IDCHEBI:189462
ChEBI Nameisorhamnetin-3-O-nehesperidine
Stars
ASCII Nameisorhamnetin-3-O-nehesperidine
Last Modified9 March 2026
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H32O16
Net Charge0
Average Mass624.548
Monoisotopic Mass624.16903
SMILESCOc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)ccc1O
InChIInChI=1S/C28H32O16/c1-9-18(33)21(36)23(38)27(40-9)44-26-22(37)19(34)16(8-29)42-28(26)43-25-20(35)17-13(32)6-11(30)7-15(17)41-24(25)10-3-4-12(31)14(5-10)39-2/h3-7,9,16,18-19,21-23,26-34,36-38H,8H2,1-2H3/t9-,16+,18-,19+,21+,22-,23+,26+,27-,28-/m0/s1
InChIKeyQHLKSZBFIJJREC-SPSUIZEHSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) leaf sheath (BTO:0005094) MetaboLights (MTBLS3518)
ChEBI Ontology
Outgoing Relation(s)
isorhamnetin-3-O-nehesperidine (CHEBI:189462) is a flavonoids (CHEBI:72544)
isorhamnetin-3-O-nehesperidine (CHEBI:189462) is a glycoside (CHEBI:24400)
IUPAC Name 
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-3-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside
Manual XrefsDatabases
9839240ChemSpider
LMPK12110585LIPID MAPS