Basic information
- CAS
1244-78-6- Standard SMILES
COc1cc(OC)c2c(=O)c(O)c(-c3ccc(OC)c(OC)c3)oc2c1- InChIKey
AAASNKNLMQBKFV-UHFFFAOYSA-N- Molecular formula
- C19H18O7
- Average molar mass
- 358.3 g/mol
- Monoisotopic mass
- 358.10525291
Overview
Quercetin 5,7,3',4'-tetramethyl ether is a tetramethoxyflavone that is the 5,7,3',4'-tetramethy-derivative of quercetin. It has a role as a plant metabolite. It is a member of flavonols and a tetramethoxyflavone. It is functionally related to a quercetin.
Names & identifiers
- Preferred name
- Quercetin 5,7,3',4'-tetramethyl ether
- IUPAC
- 2-(3,4-dimethoxyphenyl)-3-hydroxy-5,7-dimethoxychromen-4-one
- English name
- 3-Hydroxy-3,4, 5,7-tetramethoxyflavone
- Molecular formula
- C19H18O7
- Molecular weight
- 358.34
Names & synonyms
1244-78-63-Hydroxy-3',4',5,7-tetramethoxyflavone2-(3,4-Dimethoxyphenyl)-3-hydroxy-5,7-dimethoxy-4H-chromen-4-oneQuercetin 5,7,3',4'-tetramethyl etherFlavone, 3-hydroxy-3',4',5,7-tetramethoxy-CHEBI:85124DTXSID401543194H-1-Benzopyran-4-one, 2-(3,4-dimethoxyphenyl)-3-hydroxy-5,7-dimethoxy-RefChem:1097743DTXCID7076810Averionol3-Hydroxy-3,4, 5,7-tetramethoxyflavone
Show more names
Quercetin-3',4',5,7-tetramethyl etherQuercetin-3',4',5,7-tetramethyl ether5-hydroxy-7,3',4',5'-tetramethoxyflavone2-(3,4-dimethoxyphenyl)-3-hydroxy-5,7-dimethoxy-4H-4-chromenone4H-1-Benzopyran-4-one,2-(3,4-dimethoxyphenyl)-3-hydroxy-5,7-dimethoxy-
NSC1020492-(3,4-dimethoxyphenyl)-3-hydroxy-5,7-dimethoxychromen-4-oneUUX3TU2JXT3',4',5,7-TetramethylquercetinQUERCETIN TETRAMETHYL (5,7,3',4') ETHERNSC-102049Quercetin tetramethyl(3',4',5,7) ether2-(3,4-dimethoxyphenyl)-3-hydroxy-5,7-dimethoxy-chromen-4-one
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 83.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 546
Experimental & physicochemical properties
LipidsPolyketides [PK] -> Flavonoids [PK12] -> Flavones and Flavonols [PK1211]
Physicochemical properties
- Melting point
- 195.6 °C · 195.6 °C
- Boiling point
- 550.9 · 550.9±50.0 °C(Predicted)
- Density
- 1.325 · 1.325±0.06 g/cm3(Predicted)
- pka
- 7.98 · 7.98±0.20(Predicted)
- FDA UNII
- 3 TU2JXT · UUX3TU2JXT
Chemistry & industry
Suppliers14 total
成都乐美天医药科技有限公司17308096051 17308096051 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
成都仪睿生物科技有限公司18224028459 18224028459 · [email protected]
成都仪捷睿生物科技有限公司18224018291 18224018291 · [email protected]
上海皓之翔生物科技有限公司（原上海拓青化工有限公司）526763801 13301653310 · [email protected]
上海萄普生物医药技术有限公司15900573766 18018507602 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
上海百韧生物科技有限公司13564638271 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
资川生化科技(苏州)有限公司0512-66317708 13372112871 · [email protected]
Shaanxi Dideu Medichem Co. Ltd+86-17392712779 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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