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548-75-4

548-75-4 Structure

548-75-4 Structure
IdentificationBack Directory
[Name]

Quercetagetin-7-O-glucoside
[CAS]

548-75-4
[Synonyms]

Quercetagitrin
Queccetagitrin
Quercetagetin-7-O-glucoside
Quercetagetin-7-O-β-D-glucoside
Quercetagetin-7-O-β-glucopyranoside
QUERCETAGETIN-7-O-GLUCOSIDE WITH HPLC
7-[(β-D-Glucopyranosyl)oxy]-3,3',4',5,6-pentahydroxyflavone
2-(3,4-Dihydroxyphenyl)-3,5,6-trihydroxy-7-(β-D-glucopyranosyloxy)-4H-1-benzopyran-4-one
2-(3,4-Dihydroxyphenyl)-7-(β-D-glucopyranosyloxy)-3,5,6-trihydroxy-4H-1-benzopyran-4-one
4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-7-(β-D-glucopyranosyloxy)-3,5,6-trihydroxy-
4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-7-(beta-D-glucopyranosy loxy)-3,5,6-trihydroxy-
[Molecular Formula]

C21H20O13
[MDL Number]

MFCD09263523
[MOL File]

548-75-4.mol
[Molecular Weight]

480.38
Chemical PropertiesBack Directory
[Melting point ]

236-238 °C (decomp)(Solv: pyridine (110-86-1); water (7732-18-5))
[Boiling point ]

908.0±65.0 °C(Predicted)
[density ]

1.883±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

Solid
[pka]

5.73±0.40(Predicted)
[color ]

Light yellow to yellow
[InChIKey]

IDTDRZPBDLMCLB-LCRIFCTFNA-N
[SMILES]

C12C(O)=C(O)C(=CC=1OC(C1=CC=C(O)C(O)=C1)=C(O)C2=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |&1:23,25,28,30,32,r|
Hazard InformationBack Directory
[Uses]

Quercetagitrin (Quercetagetin-7-O-glucoside), isolated from the flowers of the Marigold (Tagetes erecta), has anti-inflammatory activity[1][2].
[Definition]

ChEBI: Quercetagitrin is a member of flavonoids and a glycoside.
[References]

[1] BY P. SURYAPRAKASA RAO, et al. Isolation and constitution of quercetagitrin, a glucoside of quercetagetin. Proceedings of the Indian Academy of Sciences - Section A. 1941.
[2] Tordera M, et al. Influence of anti-inflammatory flavonoids on degranulation and arachidonic acid release in rat neutrophils. Z Naturforsch C. 1994 Mar-Apr;49(3-4):235-40. DOI:10.1515/znc-1994-3-412
Spectrum DetailBack Directory
[Spectrum Detail]

Quercetagetin-7-O-glucoside(548-75-4)1HNMR
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