|
Menu

COCONUT Compound

6-Methoxyluteolin

CNP0401834.0 · C16H12O7 · View on COCONUT ↗

2D Structure

Download 2D SDF Download 3D SDF

Identifiers

Name6-Methoxyluteolin
IUPAC Name2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-methoxy-chromen-4-one
COCONUT IDCNP0401834.0
CAS520-11-6
InChIKeyFHHSEFRSDKWJKJ-UHFFFAOYSA-N
InChIInChI=1S/C16H12O7/c1-22-16-11(20)6-13-14(15(16)21)10(19)5-12(23-13)7-2-3-8(17)9(18)4-7/h2-6,17-18,20-21H,1H3
SMILESCOC1=C(O)C=C2OC(C3=CC=C(O)C(O)=C3)=CC(=O)C2=C1O

Properties

Molecular FormulaC16H12O7
Molecular Weight316.27
Exact Mass316.05830
Log P (ALogP)2.29
TPSA120.36
H-Bond Donors / Acceptors4 / 7
Rotatable Bonds2
Lipinski's Rule of 5 Violations0
QED Drug-likeness0.54
NP-likeness1.56

Classification

NP PathwayShikimates and Phenylpropanoids
NP SuperclassFlavonoids
NP ClassFlavones
Chemical SuperclassPhenylpropanoids and polyketides
Chemical ClassFlavonoids
Chemical SubclassO-methylated flavonoids

Reported in GR-MAPs Plants

Rosmarinus officinalis as “Rosmarinus Officinalis” in COCONUT
Salvia officinalis as “Salvia officinalis” in COCONUT

References (124)

  1. 10.1002/CHIN.200332113
  2. 10.1002/CHIN.200516192
  3. 10.1002/J.1537-2197.1987.TB08600.X
  4. 10.1002/J.1537-2197.1987.TB12148.X
  5. 10.1002/MRC.2113
  6. 10.1007/BF00565037
  7. 10.1007/BF00579783
  8. 10.1007/BF01959464
  9. 10.1007/S10600-006-0088-4
  10. 10.1007/S10600-006-0228-X
  11. 10.1007/S10600-008-9024-0
  12. 10.1007/S10600-011-9798-3
  13. 10.1016/0031-9422(73)80032-9
  14. 10.1016/0031-9422(80)85136-3
  15. 10.1016/0031-9422(81)80046-5
  16. 10.1016/0031-9422(81)85192-8
  17. 10.1016/0031-9422(82)80139-8
  18. 10.1016/0031-9422(83)80044-2
  19. 10.1016/0031-9422(88)80244-9
  20. 10.1016/0031-9422(88)80471-0
  21. 10.1016/0031-9422(88)83030-9
  22. 10.1016/0031-9422(88)87035-3
  23. 10.1016/0031-9422(89)80045-7
  24. 10.1016/0031-9422(90)85301-U
  25. 10.1016/0031-9422(90)85371-L
  26. 10.1016/0031-9422(90)85371-l
  27. 10.1016/0031-9422(91)83643-Y
  28. 10.1016/0031-9422(93)85040-X
  29. 10.1016/0031-9422(94)00840-P
  30. 10.1016/0031-9422(95)00776-8
  31. 10.1016/0031-9422(95)00780-6
  32. 10.1016/0031-9422(96)00104-5
  33. 10.1016/0305-1978(83)90034-0
  34. 10.1016/0305-1978(84)90032-2
  35. 10.1016/0305-1978(85)90068-7
  36. 10.1016/0305-1978(85)90084-5
  37. 10.1016/0305-1978(88)90033-6
  38. 10.1016/0305-1978(88)90035-X
  39. 10.1016/0305-1978(88)90036-1
  40. 10.1016/0305-1978(88)90045-2

Showing 40 of 124. See all references on COCONUT.

Data from COCONUT (COlleCtion of Open Natural prodUcTs), released under CC0. Chandrasekhar V. et al. COCONUT 2.0: a comprehensive overhaul and curation of the collection of open natural products database. Nucleic Acids Research (2024), doi:10.1093/nar/gkae1063. COCONUT release 2026-10.