quercetin 3-O-rhamnoside-7-O-glucoside (CHEBI:133244)

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CHEBI:133244 - quercetin 3-O-rhamnoside-7-O-glucoside

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ChEBI ID	CHEBI:133244
ChEBI Name	quercetin 3-O-rhamnoside-7-O-glucoside
Stars
ASCII Name	quercetin 3-O-rhamnoside-7-O-glucoside
Definition	A quercetin O-glucoside that is quercetin 7-O-β-D-glucoside carrying an additional α-L-rhamnosyl residue at position 3.
Last Modified	25 February 2020
Submitter	Keeva
Downloads	Molfile

Formula	C27H30O16
Net Charge	0
Average Mass	610.521
Monoisotopic Mass	610.15338
SMILES	C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O
InChI	InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(39-8)43-25-19(34)16-13(31)5-10(40-27-23(38)21(36)18(33)15(7-28)42-27)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26-,27+/m0/s1
InChIKey	MCTZMXCUYPDYNE-AHHFARBASA-N

Species of Metabolite	Component	Source	Comments
Arabidopsis thaliana (ncbitaxon:3702)
	-	PubMed (27432888)
	-	MetaboLights (MTBLS129)
Capsicum annuum (ncbitaxon:4072)	fruit (BTO:0000486)	PubMed (25172746)

Roles Classification

Biological Role:

plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology

Outgoing Relation(s)
	quercetin 3-O-rhamnoside-7-O-glucoside (CHEBI:133244) has role plant metabolite (CHEBI:76924)
	quercetin 3-O-rhamnoside-7-O-glucoside (CHEBI:133244) is a monosaccharide derivative (CHEBI:63367)
	quercetin 3-O-rhamnoside-7-O-glucoside (CHEBI:133244) is a polyphenol (CHEBI:26195)
	quercetin 3-O-rhamnoside-7-O-glucoside (CHEBI:133244) is a quercetin O-glucoside (CHEBI:64621)
	quercetin 3-O-rhamnoside-7-O-glucoside (CHEBI:133244) is a trihydroxyflavone (CHEBI:27116)
	quercetin 3-O-rhamnoside-7-O-glucoside (CHEBI:133244) is a α-L-rhamnoside (CHEBI:27848)
	quercetin 3-O-rhamnoside-7-O-glucoside (CHEBI:133244) is a β-D-glucoside (CHEBI:22798)

IUPAC Name
3-[(6-deoxy-α-L-mannopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-1-benzopyran-7-yl β-D-glucopyranoside

Synonyms	Source
quercetin 3-O-α-rhamnoside-7-O-β-glucoside	ChEBI
quercetin 3-O-α-L-rhamnoside-7-O-β-D-glucoside	ChEBI
Quercetin 3-rhamnoside-7-glucoside	LIPID MAPS

Manual Xrefs	Databases
C00005431	KNApSAcK
CPD-8011	MetaCyc
LMPK12112199	LIPID MAPS

Registry Numbers	Sources
Reaxys:9748754	Reaxys
CAS:17306-45-5	KNApSAcK

Citations