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4',5-Dihydroxy-3'-methoxyflavon-7-olate(1-)

PubChem CID: 25203524

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Compound Synonyms 4',5-dihydroxy-3'-methoxyflavon-7-olate(1-), CHEBI:57799, 4',5-dihydroxy-3'-methoxyflavon-7-olate anion, Q27124955, 4-(5,7-dihydroxy-4-oxochromen-2-yl)-2-methoxyphenolate, 5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-7-olate
Prediction Swissadme 0.0
Topological Polar Surface Area 99.1
Hydrogen Bond Donor Count 2.0
Inchi Key SCZVLDHREVKTSH-UHFFFAOYSA-M
Fcsp3 0.0625
Rotatable Bond Count 2.0
Heavy Atom Count 22.0
Compound Name 4',5-Dihydroxy-3'-methoxyflavon-7-olate(1-)
Prediction Hob Swissadme 0.0
Exact Mass 299.056
Formal Charge -1.0
Monoisotopic Mass 299.056
Isotope Atom Count 0.0
Molecular Complexity 462.0
Hydrogen Bond Acceptor Count 6.0
Molecular Weight 299.25
Database Name cmaup_ingredients;pubchem
Covalent Unit Count 1.0
Defined Atom Stereocenter Count 0.0
Iupac Name 4-(5,7-dihydroxy-4-oxochromen-2-yl)-2-methoxyphenolate
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 0.0
Prediction Hob 1.0
Esol -3.2670814181818177
Inchi InChI=1S/C16H12O6/c1-21-14-4-8(2-3-10(14)18)13-7-12(20)16-11(19)5-9(17)6-15(16)22-13/h2-7,17-19H,1H3/p-1
Smiles COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)[O-]
Xlogp 2.4
Defined Bond Stereocenter Count 0.0
Molecular Formula C16H11O6-

  • 1. Outgoing r'ship FOUND_IN to/from Artemisia Annua (Plant) Rel Props:Source_db:cmaup_ingredients
  • 2. Outgoing r'ship FOUND_IN to/from Artemisia Anomala (Plant) Rel Props:Source_db:cmaup_ingredients
  • 3. Outgoing r'ship FOUND_IN to/from Artemisia Apiacea (Plant) Rel Props:Source_db:cmaup_ingredients
  • 4. Outgoing r'ship FOUND_IN to/from Brucea Javanica (Plant) Rel Props:Source_db:cmaup_ingredients
  • 5. Outgoing r'ship FOUND_IN to/from Campsis Grandiflora (Plant) Rel Props:Source_db:cmaup_ingredients
  • 6. Outgoing r'ship FOUND_IN to/from Cephalotaxus Fortunei (Plant) Rel Props:Source_db:cmaup_ingredients
  • 7. Outgoing r'ship FOUND_IN to/from Derris Scandens (Plant) Rel Props:Source_db:cmaup_ingredients
  • 8. Outgoing r'ship FOUND_IN to/from Dipteryx Odorata (Plant) Rel Props:Source_db:cmaup_ingredients
  • 9. Outgoing r'ship FOUND_IN to/from Elsholtzia Splendens (Plant) Rel Props:Source_db:cmaup_ingredients
  • 10. Outgoing r'ship FOUND_IN to/from Lonicera Japonica (Plant) Rel Props:Source_db:cmaup_ingredients
  • 11. Outgoing r'ship FOUND_IN to/from Meconopsis Horridula (Plant) Rel Props:Source_db:cmaup_ingredients
  • 12. Outgoing r'ship FOUND_IN to/from Oroxylum Indicum (Plant) Rel Props:Source_db:cmaup_ingredients
  • 13. Outgoing r'ship FOUND_IN to/from Pinus Aristata (Plant) Rel Props:Source_db:cmaup_ingredients
  • 14. Outgoing r'ship FOUND_IN to/from Pinus Excelsa (Plant) Rel Props:Source_db:cmaup_ingredients
  • 15. Outgoing r'ship FOUND_IN to/from Pinus Monticola (Plant) Rel Props:Source_db:cmaup_ingredients
  • 16. Outgoing r'ship FOUND_IN to/from Scutellaria Amoena (Plant) Rel Props:Source_db:cmaup_ingredients
  • 17. Outgoing r'ship FOUND_IN to/from Scutellaria Baicalensis (Plant) Rel Props:Source_db:cmaup_ingredients
  • 18. Outgoing r'ship FOUND_IN to/from Sedum Lineare (Plant) Rel Props:Source_db:cmaup_ingredients
  • 19. Outgoing r'ship FOUND_IN to/from Silybum Marianum (Plant) Rel Props:Source_db:cmaup_ingredients
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