2-(3,4-Dimethoxyphenyl)-7-hydroxy-5,6-dimethoxychromen-4-one
PubChem CID: 5491643
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| Compound Synonyms | 2-(3,4-dimethoxyphenyl)-7-hydroxy-5,6-dimethoxychromen-4-one, 40983-99-1, 7-Hydroxy-3',4',5,6-tetramethoxyflavone, 6-Hydroxyluteolin 5,6,3',4'-tetramethyl ether, X28WLH9Z2F, SCHEMBL7606758, DTXSID70193978, CHEBI:175600, QZNYGJAJWILZLF-UHFFFAOYSA-N, 2-(3,4-dimethoxyphenyl)-7-hydroxy-5,6-dimethoxy-4H-chromen-4-one, LMPK12111242, 7-hydroxy-3',4',5,6-tetramethoxy flavone, 2-(3,4-Dimethoxyphenyl)-5,6-dimethoxy-7-oxidanyl-chromen-4-one, 2-(3,4-Dimethoxyphenyl)-7-hydroxy-5,6-dimethoxy-4H-1-benzopyran-4-one, 4H-1-Benzopyran-4-one, 2-(3,4-dimethoxyphenyl)-7-hydroxy-5,6-dimethoxy- |
|---|---|
| Topological Polar Surface Area | 83.5 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 26.0 |
| Description | Isolated from Citrus reticulata (manadarin orange). 7-Hydroxy-3',4',5,6-tetramethoxyflavone is found in citrus. |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 534.0 |
| Database Name | fooddb_chem_all;hmdb_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2-(3,4-dimethoxyphenyl)-7-hydroxy-5,6-dimethoxychromen-4-one |
| Nih Violation | False |
| Class | Flavonoids |
| Xlogp | 2.7 |
| Superclass | Phenylpropanoids and polyketides |
| Is Pains | False |
| Subclass | O-methylated flavonoids |
| Molecular Formula | C19H18O7 |
| Inchi Key | QZNYGJAJWILZLF-UHFFFAOYSA-N |
| Rotatable Bond Count | 5.0 |
| State | Solid |
| Synonyms | 6-Hydroxyluteolin 5,6,3',4'-tetramethyl ether, 7-Hydroxy-3',4',5,6-tetramethoxyflavone |
| Compound Name | 2-(3,4-Dimethoxyphenyl)-7-hydroxy-5,6-dimethoxychromen-4-one |
| Kingdom | Organic compounds |
| Exact Mass | 358.105 |
| Formal Charge | 0.0 |
| Brenk Violation | False |
| Monoisotopic Mass | 358.105 |
| Hydrogen Bond Acceptor Count | 7.0 |
| Molecular Weight | 358.3 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Inchi | InChI=1S/C19H18O7/c1-22-13-6-5-10(7-15(13)23-2)14-8-11(20)17-16(26-14)9-12(21)18(24-3)19(17)25-4/h5-9,21H,1-4H3 |
| Smiles | COC1=C(C=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C(=C3OC)OC)O)OC |
| Defined Bond Stereocenter Count | 0.0 |
| Taxonomy Direct Parent | 6-O-methylated flavonoids |
- 1. Outgoing r'ship
FOUND_INto/from Citrus Reticulata (Plant) Rel Props:Source_db:fooddb_chem_all