CHEBI:140106 - quercetin 5,7,3',4'-tetramethyl ether 3-rutinoside

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ChEBI Name quercetin 5,7,3',4'-tetramethyl ether 3-rutinoside
ChEBI ID CHEBI:140106
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C31H38O16
Net Charge 0
Average Mass 666.625
Monoisotopic Mass 666.21599
InChI InChI=1S/C31H38O16/c1-12-21(32)24(35)26(37)30(44-12)43-11-19-22(33)25(36)27(38)31(46-19)47-29-23(34)20-17(42-5)9-14(39-2)10-18(20)45-28(29)13-6-7-15(40-3)16(8-13)41-4/h6-10,12,19,21-22,24-27,30-33,35-38H,11H2,1-5H3/t12?,19-,21+,22-,24?,25?,26+,27?,30-,31+/m1/s1
InChIKey MEJNXDYVXPUWEN-JFLWVOHLSA-N
SMILES C=1(C=C(C2=C(C1)OC(=C(C2=O)O[C@H]3C(C([C@@H]([C@H](O3)CO[C@H]4[C@H](C([C@H](C(O4)C)O)O)O)O)O)O)C5=CC=C(C(=C5)OC)OC)OC)OC
ChEBI Ontology
Outgoing quercetin 5,7,3',4'-tetramethyl ether 3-rutinoside (CHEBI:140106) is a flavonoids (CHEBI:72544)
quercetin 5,7,3',4'-tetramethyl ether 3-rutinoside (CHEBI:140106) is a glycoside (CHEBI:24400)
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Last Modified
13 февраля 2018