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CHEBI:140097 - acacetin 7-O-[2'''-O-rhamnosyl]-2''-O-glucosylglucoside

Default Structure
ChEBI IDCHEBI:140097
ChEBI Nameacacetin 7-O-[2'''-O-rhamnosyl]-2''-O-glucosylglucoside
Stars
ASCII Nameacacetin 7-O-[2'''-O-rhamnosyl]-2''-O-glucosylglucoside
Last Modified12 February 2018
Submittermwilliams
DownloadsMolfile
FormulaC34H42O19
Net Charge0
Average Mass754.691
Monoisotopic Mass754.23203
SMILESCOc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4OC(CO)[C@@H](O)C(O)[C@@H]4O[C@@H]4OC(CO)[C@@H](O)C(O)[C@@H]4O[C@@H]4OC(C)[C@H](O)[C@H](O)C4O)cc3o2)cc1
InChIInChI=1S/C34H42O19/c1-12-23(39)26(42)29(45)32(47-12)52-31-28(44)25(41)21(11-36)51-34(31)53-30-27(43)24(40)20(10-35)50-33(30)48-15-7-16(37)22-17(38)9-18(49-19(22)8-15)13-3-5-14(46-2)6-4-13/h3-9,12,20-21,23-37,39-45H,10-11H2,1-2H3/t12?,20?,21?,23-,24+,25+,26-,27?,28?,29?,30-,31-,32-,33+,34-/m0/s1
InChIKeyNSHODVPTAXCSGW-PTFFPCJOSA-N
ChEBI Ontology
Outgoing Relation(s)
acacetin 7-O-[2'''-O-rhamnosyl]-2''-O-glucosylglucoside (CHEBI:140097) is a flavonoids (CHEBI:72544)
acacetin 7-O-[2'''-O-rhamnosyl]-2''-O-glucosylglucoside (CHEBI:140097) is a glycoside (CHEBI:24400)
Manual XrefsDatabases
LMPK12110460LIPID MAPS