CHEBI:136620 - Myricetin 3-(3''-galloylrhamnoside)

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ChEBI Name Myricetin 3-(3''-galloylrhamnoside)
ChEBI ID CHEBI:136620
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C28H24O16
Net Charge 0
Average Mass 616.482
Monoisotopic Mass 616.10643
InChI InChI=1S/C28H24O16/c1-8-19(35)25(43-27(40)10-4-15(33)21(37)16(34)5-10)23(39)28(41-8)44-26-22(38)18-12(30)6-11(29)7-17(18)42-24(26)9-2-13(31)20(36)14(32)3-9/h2-8,19,23,25,28-37,39H,1H3
InChIKey AHOPFKRXJRLLGF-UHFFFAOYSA-N
SMILES C=1(O)C(O)=CC(=CC1O)C2=C(OC3C(O)C(C(C(O3)C)O)OC(C=4C=C(C(=C(C4)O)O)O)=O)C(C=5C(O2)=CC(=CC5O)O)=O
ChEBI Ontology
Outgoing Myricetin 3-(3''-galloylrhamnoside) (CHEBI:136620) is a flavonoids (CHEBI:72544)
Myricetin 3-(3''-galloylrhamnoside) (CHEBI:136620) is a glycoside (CHEBI:24400)
IUPAC Name
2- (3,4,5-Trihydroxyphenyl) -3- [ 3-O- (3,4,5-trihydroxybenzoyl) -alpha-L-rhamnopyranosyloxy ] -5,7-dihydroxy-4H-1-benzopyran-4-one
Last Modified
22 March 2017