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Quinquangulin

PubChem CID: 3008110

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Compound Synonyms Quinquangulin, 62715-75-7, CHEBI:8731, CHEMBL465319, 5,6-dihydroxy-8-methoxy-2,9-dimethylbenzo[g]chromen-4-one, DTXSID90388344, 5,6-dihydroxy-8-methoxy-2,9-dimethyl-benzo[g]chromen-4-one, C09044, 4H-Naphtho(2,3-b)pyran-4-one, 5,6-dihydroxy-8-methoxy-2,7-dimethyl-, AC1MHNKN, 5,6-dihydroxy-8-methoxy-2,9-dimethylbenzo(g)chromen-4-one, 5,6-dihydroxy-8-methoxy-2,9-dimethyl-benzo(g)chromen-4-one, CTK2B3873, SureCN4742445, SCHEMBL4742445, DTXCID80339365, Q27108140
Topological Polar Surface Area 76.0
Hydrogen Bond Donor Count 2.0
Heavy Atom Count 21.0
Isotope Atom Count 0.0
Molecular Complexity 460.0
Database Name cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Iupac Name 5,6-dihydroxy-8-methoxy-2,9-dimethylbenzo[g]chromen-4-one
Prediction Hob 1.0
Xlogp 3.3
Molecular Formula C16H14O5
Prediction Swissadme 0.0
Inchi Key RWYDRASBOZUJPY-UHFFFAOYSA-N
Fcsp3 0.1875
Logs -3.643
Rotatable Bond Count 1.0
Logd 2.602
Compound Name Quinquangulin
Prediction Hob Swissadme 0.0
Exact Mass 286.084
Formal Charge 0.0
Monoisotopic Mass 286.084
Hydrogen Bond Acceptor Count 5.0
Molecular Weight 286.28
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 0.0
Esol -3.6550879333333333
Inchi InChI=1S/C16H14O5/c1-7-4-10(17)15-13(21-7)5-9-8(2)12(20-3)6-11(18)14(9)16(15)19/h4-6,18-19H,1-3H3
Smiles CC1=CC(=O)C2=C(O1)C=C3C(=C(C=C(C3=C2O)O)OC)C
Nring 3.0
Defined Bond Stereocenter Count 0.0

  • 1. Outgoing r'ship FOUND_IN to/from Blumea Obliqua (Plant) Rel Props:Reference:
  • 2. Outgoing r'ship FOUND_IN to/from Cassia Absus (Plant) Rel Props:Reference:
  • 3. Outgoing r'ship FOUND_IN to/from Cassia Acutifolia (Plant) Rel Props:Reference:
  • 4. Outgoing r'ship FOUND_IN to/from Cassia Alata (Plant) Rel Props:Reference:
  • 5. Outgoing r'ship FOUND_IN to/from Cassia Angustifolia (Plant) Rel Props:Reference:
  • 6. Outgoing r'ship FOUND_IN to/from Cassia Artemisioides (Plant) Rel Props:Reference:
  • 7. Outgoing r'ship FOUND_IN to/from Cassia Auriculata (Plant) Rel Props:Reference:
  • 8. Outgoing r'ship FOUND_IN to/from Cassia Carnaval (Plant) Rel Props:Reference:
  • 9. Outgoing r'ship FOUND_IN to/from Cassia Dentata (Plant) Rel Props:Reference:
  • 10. Outgoing r'ship FOUND_IN to/from Cassia Fistula (Plant) Rel Props:Reference:
  • 11. Outgoing r'ship FOUND_IN to/from Cassia Garrettiana (Plant) Rel Props:Reference:
  • 12. Outgoing r'ship FOUND_IN to/from Cassia Glauca (Plant) Rel Props:Reference:
  • 13. Outgoing r'ship FOUND_IN to/from Cassia Grandis (Plant) Rel Props:Reference:
  • 14. Outgoing r'ship FOUND_IN to/from Cassia Hirsuta (Plant) Rel Props:Reference:
  • 15. Outgoing r'ship FOUND_IN to/from Cassia Italica (Plant) Rel Props:Reference:
  • 16. Outgoing r'ship FOUND_IN to/from Cassia Jahnii (Plant) Rel Props:Reference:
  • 17. Outgoing r'ship FOUND_IN to/from Cassia Javanica (Plant) Rel Props:Reference:
  • 18. Outgoing r'ship FOUND_IN to/from Cassia Kleinii (Plant) Rel Props:Reference:
  • 19. Outgoing r'ship FOUND_IN to/from Cassia Lanceolata (Plant) Rel Props:Reference:
  • 20. Outgoing r'ship FOUND_IN to/from Cassia Leptophylla (Plant) Rel Props:Reference:
  • 21. Outgoing r'ship FOUND_IN to/from Cassia Mimosoides (Plant) Rel Props:Reference:
  • 22. Outgoing r'ship FOUND_IN to/from Cassia Montana (Plant) Rel Props:Reference:
  • 23. Outgoing r'ship FOUND_IN to/from Cassia Nodosa (Plant) Rel Props:Reference:
  • 24. Outgoing r'ship FOUND_IN to/from Cassia Obovata (Plant) Rel Props:Reference:
  • 25. Outgoing r'ship FOUND_IN to/from Cassia Obtusifolia (Plant) Rel Props:Reference:
  • 26. Outgoing r'ship FOUND_IN to/from Cassia Occidentalis (Plant) Rel Props:Reference:
  • 27. Outgoing r'ship FOUND_IN to/from Cassia Ovata (Plant) Rel Props:Reference:
  • 28. Outgoing r'ship FOUND_IN to/from Cassia Pumila (Plant) Rel Props:Reference:
  • 29. Outgoing r'ship FOUND_IN to/from Cassia Quinquangula (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 30. Outgoing r'ship FOUND_IN to/from Cassia Renigera (Plant) Rel Props:Reference:
  • 31. Outgoing r'ship FOUND_IN to/from Cassia Roxburghii (Plant) Rel Props:Reference:
  • 32. Outgoing r'ship FOUND_IN to/from Cassia Senna (Plant) Rel Props:Reference:
  • 33. Outgoing r'ship FOUND_IN to/from Cassia Siamea (Plant) Rel Props:Reference:
  • 34. Outgoing r'ship FOUND_IN to/from Cassia Sieberiana (Plant) Rel Props:Reference:
  • 35. Outgoing r'ship FOUND_IN to/from Cassia Singueana (Plant) Rel Props:Reference:
  • 36. Outgoing r'ship FOUND_IN to/from Cassia Sophera (Plant) Rel Props:Reference:
  • 37. Outgoing r'ship FOUND_IN to/from Cassia Spectabilis (Plant) Rel Props:Reference:
  • 38. Outgoing r'ship FOUND_IN to/from Cassia Surattensis (Plant) Rel Props:Reference:
  • 39. Outgoing r'ship FOUND_IN to/from Cassia Tora (Plant) Rel Props:Reference:
  • 40. Outgoing r'ship FOUND_IN to/from Chrozophora Obliqua (Plant) Rel Props:Reference:
  • 41. Outgoing r'ship FOUND_IN to/from Cinnamomum Cassia (Plant) Rel Props:Reference:
  • 42. Outgoing r'ship FOUND_IN to/from Eucalyptus Obliqua (Plant) Rel Props:Reference:
  • 43. Outgoing r'ship FOUND_IN to/from Neolitsea Cassia (Plant) Rel Props:Reference:
  • 44. Outgoing r'ship FOUND_IN to/from Senna Alata (Plant) Rel Props:Reference:
  • 45. Outgoing r'ship FOUND_IN to/from Senna Alexandrina (Plant) Rel Props:Reference:
  • 46. Outgoing r'ship FOUND_IN to/from Senna Auriculata (Plant) Rel Props:Reference:
  • 47. Outgoing r'ship FOUND_IN to/from Senna Didymobotrya (Plant) Rel Props:Reference:
  • 48. Outgoing r'ship FOUND_IN to/from Senna Floribunda (Plant) Rel Props:Reference:
  • 49. Outgoing r'ship FOUND_IN to/from Senna Hirsuta (Plant) Rel Props:Reference:
  • 50. Outgoing r'ship FOUND_IN to/from Senna Holosericea (Plant) Rel Props:Reference:
  • 51. Outgoing r'ship FOUND_IN to/from Senna Insularis (Plant) Rel Props:Reference:
  • 52. Outgoing r'ship FOUND_IN to/from Senna Italica (Plant) Rel Props:Reference:
  • 53. Outgoing r'ship FOUND_IN to/from Senna Lindheimeriana (Plant) Rel Props:Reference:
  • 54. Outgoing r'ship FOUND_IN to/from Senna Montana (Plant) Rel Props:Reference:
  • 55. Outgoing r'ship FOUND_IN to/from Senna Multiglandulosa (Plant) Rel Props:Reference:
  • 56. Outgoing r'ship FOUND_IN to/from Senna Multijuga (Plant) Rel Props:Reference:
  • 57. Outgoing r'ship FOUND_IN to/from Senna Obtusifolia (Plant) Rel Props:Reference:
  • 58. Outgoing r'ship FOUND_IN to/from Senna Occidentalis (Plant) Rel Props:Reference:
  • 59. Outgoing r'ship FOUND_IN to/from Senna Prostrata (Plant) Rel Props:Reference:
  • 60. Outgoing r'ship FOUND_IN to/from Senna Septemtrionalis (Plant) Rel Props:Reference:
  • 61. Outgoing r'ship FOUND_IN to/from Senna Siamea (Plant) Rel Props:Reference:
  • 62. Outgoing r'ship FOUND_IN to/from Senna Sophera (Plant) Rel Props:Reference:
  • 63. Outgoing r'ship FOUND_IN to/from Senna Spectabilis (Plant) Rel Props:Reference:
  • 64. Outgoing r'ship FOUND_IN to/from Senna Surattensis (Plant) Rel Props:Reference:
  • 65. Outgoing r'ship FOUND_IN to/from Senna Timoriensis (Plant) Rel Props:Reference:
  • 66. Outgoing r'ship FOUND_IN to/from Senna Tora (Plant) Rel Props:Reference:
  • 67. Outgoing r'ship FOUND_IN to/from Senna Uniflora (Plant) Rel Props:Reference:
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