2,4,7-Trihydroxy-5-methoxy-9H-fluoren-9-one
PubChem CID: 71441453
Connections displayed (default: 10).
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| Compound Synonyms | 560096-22-2, 9H-Fluoren-9-one, 2,4,7-trihydroxy-5-methoxy-, 2,4,7-TRIHYDROXY-5-METHOXY-9H-FLUOREN-9-ONE, CHEMBL2333783, DTXSID60850386, 2,4,7-trihydroxy-5-methoxy-9-fluorenone |
|---|---|
| Topological Polar Surface Area | 87.0 |
| Hydrogen Bond Donor Count | 3.0 |
| Heavy Atom Count | 19.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 371.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2,4,7-trihydroxy-5-methoxyfluoren-9-one |
| Prediction Hob | 1.0 |
| Xlogp | 2.0 |
| Molecular Formula | C14H10O5 |
| Prediction Swissadme | 0.0 |
| Inchi Key | DILPYVBUOBXTTA-UHFFFAOYSA-N |
| Fcsp3 | 0.0714285714285714 |
| Logs | -4.24 |
| Rotatable Bond Count | 1.0 |
| Logd | 2.444 |
| Compound Name | 2,4,7-Trihydroxy-5-methoxy-9H-fluoren-9-one |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 258.053 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 258.053 |
| Hydrogen Bond Acceptor Count | 5.0 |
| Molecular Weight | 258.23 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.0834882210526313 |
| Inchi | InChI=1S/C14H10O5/c1-19-11-5-7(16)3-9-13(11)12-8(14(9)18)2-6(15)4-10(12)17/h2-5,15-17H,1H3 |
| Smiles | COC1=CC(=CC2=C1C3=C(C2=O)C=C(C=C3O)O)O |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Arundina Chinensis (Plant) Rel Props:Reference: - 2. Outgoing r'ship
FOUND_INto/from Arundina Graminifolia (Plant) Rel Props:Reference: - 3. Outgoing r'ship
FOUND_INto/from Arundina Gramnifolia (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Chamaemelum Nobile (Plant) Rel Props:Reference: - 5. Outgoing r'ship
FOUND_INto/from Dendrobium Amoenum (Plant) Rel Props:Reference: - 6. Outgoing r'ship
FOUND_INto/from Dendrobium Amplum (Plant) Rel Props:Reference: - 7. Outgoing r'ship
FOUND_INto/from Dendrobium Aphyllum (Plant) Rel Props:Reference: - 8. Outgoing r'ship
FOUND_INto/from Dendrobium Ariaeflorum (Plant) Rel Props:Reference: - 9. Outgoing r'ship
FOUND_INto/from Dendrobium Aurantiacum (Plant) Rel Props:Reference: - 10. Outgoing r'ship
FOUND_INto/from Dendrobium Candidum (Plant) Rel Props:Reference: - 11. Outgoing r'ship
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FOUND_INto/from Dendrobium Chrysanthum (Plant) Rel Props:Reference: - 13. Outgoing r'ship
FOUND_INto/from Dendrobium Chrysotoxum (Plant) Rel Props:Reference: - 14. Outgoing r'ship
FOUND_INto/from Dendrobium Crepidatum (Plant) Rel Props:Reference: - 15. Outgoing r'ship
FOUND_INto/from Dendrobium Cumulatum (Plant) Rel Props:Reference: - 16. Outgoing r'ship
FOUND_INto/from Dendrobium Densiflorum (Plant) Rel Props:Reference: - 17. Outgoing r'ship
FOUND_INto/from Dendrobium Devosianum (Plant) Rel Props:Reference: - 18. Outgoing r'ship
FOUND_INto/from Dendrobium Fimbriatum (Plant) Rel Props:Reference: - 19. Outgoing r'ship
FOUND_INto/from Dendrobium Loddigesii (Plant) Rel Props:Reference: - 20. Outgoing r'ship
FOUND_INto/from Dendrobium Macraei (Plant) Rel Props:Reference: - 21. Outgoing r'ship
FOUND_INto/from Dendrobium Macrostachyum (Plant) Rel Props:Reference: - 22. Outgoing r'ship
FOUND_INto/from Dendrobium Moniliforme (Plant) Rel Props:Reference: - 23. Outgoing r'ship
FOUND_INto/from Dendrobium Moschatum (Plant) Rel Props:Reference: - 24. Outgoing r'ship
FOUND_INto/from Dendrobium Nobile (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 25. Outgoing r'ship
FOUND_INto/from Dendrobium Polyanthum (Plant) Rel Props:Reference: - 26. Outgoing r'ship
FOUND_INto/from Dendrobium Rotundatum (Plant) Rel Props:Reference: - 27. Outgoing r'ship
FOUND_INto/from Dendrobium Secundum (Plant) Rel Props:Reference: - 28. Outgoing r'ship
FOUND_INto/from Dendrobium Thyrsiflorum (Plant) Rel Props:Reference: