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CHEBI:176169 - Isowertin 2''-rhamnoside

ChEBI IDCHEBI:176169
ChEBI NameIsowertin 2''-rhamnoside
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SubmitterMetaboLights
DownloadsMolfile
FormulaC28H32O14
Net Charge0
Average Mass592.550
Monoisotopic Mass592.17921
SMILESCOc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1C1OC(CO)C(O)C(O)C1OC1OC(C)C(O)C(O)C1O
InChIInChI=1S/C28H32O14/c1-10-20(33)22(35)24(37)28(39-10)42-27-23(36)21(34)17(9-29)41-26(27)19-16(38-2)8-14(32)18-13(31)7-15(40-25(18)19)11-3-5-12(30)6-4-11/h3-8,10,17,20-24,26-30,32-37H,9H2,1-2H3
InChIKeyHFUYHHROXLKXRR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Isowertin 2''-rhamnoside (CHEBI:176169) is a C-glycosyl compound (CHEBI:20857)
Isowertin 2''-rhamnoside (CHEBI:176169) is a flavonoids (CHEBI:72544)
IUPAC Name 
8-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxychromen-4-one
Manual XrefsDatabases
HMDB0037417HMDB
24785154ChemSpider