5,7-Dihydroxy-6,8,2',3'-tetramethoxyflavone
PubChem CID: 5316833
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| Compound Synonyms | 5,7-Dihydroxy-6,8,2',3'-tetramethoxyflavone |
|---|---|
| Topological Polar Surface Area | 104.0 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 27.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 564.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2-(2,3-dimethoxyphenyl)-5,7-dihydroxy-6,8-dimethoxychromen-4-one |
| Prediction Hob | 1.0 |
| Xlogp | 2.9 |
| Molecular Formula | C19H18O8 |
| Prediction Swissadme | 0.0 |
| Inchi Key | DSNICWRJCXGVEE-UHFFFAOYSA-N |
| Fcsp3 | 0.2105263157894736 |
| Logs | -4.021 |
| Rotatable Bond Count | 5.0 |
| Logd | 2.263 |
| Compound Name | 5,7-Dihydroxy-6,8,2',3'-tetramethoxyflavone |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 374.1 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 374.1 |
| Hydrogen Bond Acceptor Count | 8.0 |
| Molecular Weight | 374.3 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.605057518518519 |
| Inchi | InChI=1S/C19H18O8/c1-23-11-7-5-6-9(16(11)24-2)12-8-10(20)13-14(21)18(25-3)15(22)19(26-4)17(13)27-12/h5-8,21-22H,1-4H3 |
| Smiles | COC1=CC=CC(=C1OC)C2=CC(=O)C3=C(C(=C(C(=C3O2)OC)O)OC)O |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Artemisia Annua (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Scutellaria Baicalensis (Plant) Rel Props:Source_db:cmaup_ingredients