4'-Hydroxy-7-Methoxyflavone
PubChem CID: 676307
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | Isopratol, 4'-Hydroxy-7-methoxyflavone, TNP00058, 7-Methoxy-4'-hydroxyflavone, SCHEMBL312254, CHEMBL1600520, DZUKXCCSULKRJA-UHFFFAOYSA-N, LMPK12110036, AKOS024282393, NCGC00017194-01, NCGC00017194-02, NCGC00142438-01, 4'-hydroxy-7-methoxyflavone, AldrichCPR, Q63392760, 4H-1-Benzopyran-4-one, 2-(4-hydroxyphenyl)-7-methoxy-, 109-169-6 |
|---|---|
| Topological Polar Surface Area | 55.8 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 20.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 395.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | Q03164, Q99714, B2RXH2, P10636, P33261, P00352, P15428, P04637, P10635, P08684, P11712, P04062, Q9NUW8, P27695 |
| Iupac Name | 2-(4-hydroxyphenyl)-7-methoxychromen-4-one |
| Prediction Hob | 1.0 |
| Target Id | NPT149, NPT48, NPT51, NPT213, NPT94, NPT151, NPT539, NPT110, NPT109, NPT212 |
| Xlogp | 3.6 |
| Molecular Formula | C16H12O4 |
| Prediction Swissadme | 0.0 |
| Inchi Key | DZUKXCCSULKRJA-UHFFFAOYSA-N |
| Fcsp3 | 0.0625 |
| Logs | -3.883 |
| Rotatable Bond Count | 2.0 |
| Logd | 2.969 |
| Compound Name | 4'-Hydroxy-7-Methoxyflavone |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 268.074 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 268.074 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 268.26 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.2295616 |
| Inchi | InChI=1S/C16H12O4/c1-19-12-6-7-13-14(18)9-15(20-16(13)8-12)10-2-4-11(17)5-3-10/h2-9,17H,1H3 |
| Smiles | COC1=CC2=C(C=C1)C(=O)C=C(O2)C3=CC=C(C=C3)O |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Glycyrrhiza Yunnanensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all