Naringenin trimethyl ether
PubChem CID: 5003667
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| Compound Synonyms | Naringenin trimethyl ether, 38302-15-7, 5,7-Dimethoxy-2-(4-methoxyphenyl)chroman-4-one, 5,7-dimethoxy-2-(4-methoxyphenyl)-2,3-dihydrochromen-4-one, 5,7,4'-Trimethoxyflavanone, 4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dimethoxy-2-(4-methoxyphenyl)-, Naringenintrimethylether, Oprea1_436908, 5, 4' Trimethoxy Flavanone, CHEMBL483550, SCHEMBL4826267, MQFSCAHSIUPLSB-UHFFFAOYSA-N, LMPK12140596, NSC735006, AKOS022184617, NSC-735006, 66074-95-1, DA-65938, XN161726, DB-118250, SR 13188, Sakuranetin dimethyl ether, 5,7,4'-Trimethoxyflavanone, (2S)-2,3-Dihydro-5,7-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4- one |
|---|---|
| Topological Polar Surface Area | 54.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 23.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 404.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 5,7-dimethoxy-2-(4-methoxyphenyl)-2,3-dihydrochromen-4-one |
| Prediction Hob | 1.0 |
| Xlogp | 2.8 |
| Molecular Formula | C18H18O5 |
| Prediction Swissadme | 1.0 |
| Inchi Key | MQFSCAHSIUPLSB-UHFFFAOYSA-N |
| Fcsp3 | 0.2777777777777778 |
| Logs | -5.34 |
| Rotatable Bond Count | 4.0 |
| Logd | 3.08 |
| Compound Name | Naringenin trimethyl ether |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 314.115 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 314.115 |
| Hydrogen Bond Acceptor Count | 5.0 |
| Molecular Weight | 314.3 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.7694763565217397 |
| Inchi | InChI=1S/C18H18O5/c1-20-12-6-4-11(5-7-12)15-10-14(19)18-16(22-3)8-13(21-2)9-17(18)23-15/h4-9,15H,10H2,1-3H3 |
| Smiles | COC1=CC=C(C=C1)C2CC(=O)C3=C(O2)C=C(C=C3OC)OC |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Edgeworthia Gardneri (Plant) Rel Props:Reference: - 2. Outgoing r'ship
FOUND_INto/from Goniothalamus Amuyon (Plant) Rel Props:Reference: - 3. Outgoing r'ship
FOUND_INto/from Goniothalamus Arvensis (Plant) Rel Props:Reference: - 4. Outgoing r'ship
FOUND_INto/from Goniothalamus Borneensis (Plant) Rel Props:Reference: - 5. Outgoing r'ship
FOUND_INto/from Goniothalamus Cheliensis (Plant) Rel Props:Reference: - 6. Outgoing r'ship
FOUND_INto/from Goniothalamus Dolichocarpus (Plant) Rel Props:Reference: - 7. Outgoing r'ship
FOUND_INto/from Goniothalamus Gardneri (Plant) Rel Props:Source_db:npass_chem_all - 8. Outgoing r'ship
FOUND_INto/from Goniothalamus Giganteus (Plant) Rel Props:Reference: - 9. Outgoing r'ship
FOUND_INto/from Goniothalamus Griffithii (Plant) Rel Props:Reference: - 10. Outgoing r'ship
FOUND_INto/from Goniothalamus Howii (Plant) Rel Props:Reference: - 11. Outgoing r'ship
FOUND_INto/from Goniothalamus Leiocarpus (Plant) Rel Props:Reference: - 12. Outgoing r'ship
FOUND_INto/from Goniothalamus Macranthus (Plant) Rel Props:Reference: - 13. Outgoing r'ship
FOUND_INto/from Goniothalamus Malayanus (Plant) Rel Props:Reference: - 14. Outgoing r'ship
FOUND_INto/from Goniothalamus Sesquipedalis (Plant) Rel Props:Reference: - 15. Outgoing r'ship
FOUND_INto/from Goniothalamus Thwaitesii (Plant) Rel Props:Reference: - 16. Outgoing r'ship
FOUND_INto/from Goniothalamus Undulatus (Plant) Rel Props:Reference: - 17. Outgoing r'ship
FOUND_INto/from Goniothalamus Waynaadensis (Plant) Rel Props:Reference: - 18. Outgoing r'ship
FOUND_INto/from Goniothalamus Wightii (Plant) Rel Props:Reference: