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9-Hydroxy-5,6-dihydrofuro[3,2-g]chromen-7-one

PubChem CID: 29920867

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Compound Synonyms SCHEMBL4383185, AKOS015961084, AC-13005
Topological Polar Surface Area 59.7
Hydrogen Bond Donor Count 1.0
Heavy Atom Count 15.0
Isotope Atom Count 0.0
Molecular Complexity 278.0
Database Name cmaup_ingredients;pubchem
Defined Atom Stereocenter Count 0.0
Iupac Name 9-hydroxy-5,6-dihydrofuro[3,2-g]chromen-7-one
Prediction Hob 1.0
Xlogp 1.7
Molecular Formula C11H8O4
Prediction Swissadme 0.0
Inchi Key PQXZXDMORSYKDE-UHFFFAOYSA-N
Fcsp3 0.1818181818181818
Logs -3.554
Rotatable Bond Count 0.0
Logd 2.081
Compound Name 9-Hydroxy-5,6-dihydrofuro[3,2-g]chromen-7-one
Prediction Hob Swissadme 0.0
Exact Mass 204.042
Formal Charge 0.0
Monoisotopic Mass 204.042
Hydrogen Bond Acceptor Count 4.0
Molecular Weight 204.18
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 0.0
Esol -2.6146222
Inchi InChI=1S/C11H8O4/c12-8-2-1-6-5-7-3-4-14-10(7)9(13)11(6)15-8/h3-5,13H,1-2H2
Smiles C1CC(=O)OC2=C1C=C3C=COC3=C2O
Nring 3.0
Defined Bond Stereocenter Count 0.0

  • 1. Outgoing r'ship FOUND_IN to/from Ammi Majus (Plant) Rel Props:Source_db:cmaup_ingredients
  • 2. Outgoing r'ship FOUND_IN to/from Angelica Archangelica (Plant) Rel Props:Source_db:cmaup_ingredients
  • 3. Outgoing r'ship FOUND_IN to/from Angelica Dahurica (Plant) Rel Props:Source_db:cmaup_ingredients
  • 4. Outgoing r'ship FOUND_IN to/from Angelica Furcijuga (Plant) Rel Props:Source_db:cmaup_ingredients
  • 5. Outgoing r'ship FOUND_IN to/from Angelica Officinalis (Plant) Rel Props:Source_db:cmaup_ingredients
  • 6. Outgoing r'ship FOUND_IN to/from Angelica Pubescens (Plant) Rel Props:Source_db:cmaup_ingredients
  • 7. Outgoing r'ship FOUND_IN to/from Angelica Taiwaniana (Plant) Rel Props:Source_db:cmaup_ingredients
  • 8. Outgoing r'ship FOUND_IN to/from Changium Smyrnioides (Plant) Rel Props:Source_db:cmaup_ingredients
  • 9. Outgoing r'ship FOUND_IN to/from Citrus Trifoliata (Plant) Rel Props:Source_db:cmaup_ingredients
  • 10. Outgoing r'ship FOUND_IN to/from Cnidium Monnieri (Plant) Rel Props:Source_db:cmaup_ingredients
  • 11. Outgoing r'ship FOUND_IN to/from Glehnia Littoralis (Plant) Rel Props:Source_db:cmaup_ingredients
  • 12. Outgoing r'ship FOUND_IN to/from Hansenia Weberbaueriana (Plant) Rel Props:Source_db:cmaup_ingredients
  • 13. Outgoing r'ship FOUND_IN to/from Heracleum Sphondylium (Plant) Rel Props:Source_db:cmaup_ingredients
  • 14. Outgoing r'ship FOUND_IN to/from Pastinaca Sativa (Plant) Rel Props:Source_db:cmaup_ingredients
  • 15. Outgoing r'ship FOUND_IN to/from Peucedanum Rubricaule (Plant) Rel Props:Source_db:cmaup_ingredients
  • 16. Outgoing r'ship FOUND_IN to/from Pleurospermum Rivulorum (Plant) Rel Props:Source_db:cmaup_ingredients
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