5,6,7,3',4',5'-Hexamethoxyflavone
PubChem CID: 185670
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | 29043-07-0, 5,6,7,3',4',5'-Hexamethoxyflavone, 3',4',5',5,6,7-HEXAMETHOXYFLAVONE, 5,6,7-trimethoxy-2-(3,4,5-trimethoxyphenyl)chromen-4-one, 5,6,7-trimethoxy-2-(3,4,5-trimethoxyphenyl)-4H-chromen-4-one, 3',4',5,5',6,7-Hexamethoxyflavone, CHEMBL370963, DTXSID40183280, 4H-1-Benzopyran-4-one, 5,6,7-trimethoxy-2-(3,4,5-trimethoxyphenyl)-, 3 inverted exclamation marka,4 inverted exclamation marka,5 inverted exclamation marka,5,6,7-Hexamethoxyflavone, MFCD00017679, SCHEMBL1765114, 5673'4'5'-Hexamethoxyflavone, DTXCID50105771, 5673'4'5'-Hexamethoxy flavone, HY-N9179, BDBM50420208, LMPK12111278, AKOS027380195, FH66258, FS-6823, 5,6,7,3',4',5'-Hexamethoxy Flavone, DB-047508, 3??,4??,5??,5,6,7-Hexamethoxyflavone, CS-0158930, 894-613-8 |
|---|---|
| Ghose Rule | True |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 81.7 |
| Hydrogen Bond Donor Count | 0.0 |
| Pfizer 3 75 Rule | False |
| Scaffold Graph Level | CC1CC(C2CCCCC2)CC2CCCCC12 |
| Np Classifier Class | Flavones |
| Deep Smiles | COccOC))cccc6OC))))ccc=O)cco6)cccc6OC)))OC)))OC |
| Heavy Atom Count | 29.0 |
| Classyfire Class | Flavonoids |
| Scaffold Graph Node Level | OC1CC(C2CCCCC2)OC2CCCCC12 |
| Classyfire Subclass | O-methylated flavonoids |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 579.0 |
| Database Name | cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P08183, Q15118 |
| Iupac Name | 5,6,7-trimethoxy-2-(3,4,5-trimethoxyphenyl)chromen-4-one |
| Prediction Hob | 1.0 |
| Veber Rule | True |
| Classyfire Superclass | Phenylpropanoids and polyketides |
| Target Id | NPT668 |
| Xlogp | 3.0 |
| Gsk 4 400 Rule | False |
| Molecular Formula | C21H22O8 |
| Scaffold Graph Node Bond Level | O=c1cc(-c2ccccc2)oc2ccccc12 |
| Prediction Swissadme | 1.0 |
| Inchi Key | DYDFNKUHYXHWFM-UHFFFAOYSA-N |
| Silicos It Class | Poorly soluble |
| Fcsp3 | 0.2857142857142857 |
| Logs | -4.045 |
| Rotatable Bond Count | 7.0 |
| Logd | 2.709 |
| Synonyms | 3',4',5,6,7,8-hexamethoxyflavone, flavone, 5,6,7,3',4',5' -hexamethoxy, flavone,5,6,7,3',4',5'-hexamethoxy |
| Esol Class | Moderately soluble |
| Functional Groups | c=O, cOC, coc |
| Compound Name | 5,6,7,3',4',5'-Hexamethoxyflavone |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 402.131 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 402.131 |
| Hydrogen Bond Acceptor Count | 8.0 |
| Molecular Weight | 402.4 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Esol | -3.679749662068967 |
| Inchi | InChI=1S/C21H22O8/c1-23-15-7-11(8-16(24-2)19(15)26-4)13-9-12(22)18-14(29-13)10-17(25-3)20(27-5)21(18)28-6/h7-10H,1-6H3 |
| Smiles | COC1=CC(=CC(=C1OC)OC)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)OC)OC |
| Nring | 3.0 |
| Np Classifier Biosynthetic Pathway | Shikimates and Phenylpropanoids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
| Np Classifier Superclass | Flavonoids |
- 1. Outgoing r'ship
FOUND_INto/from Acalypha Paniculata (Plant) Rel Props:Reference: - 2. Outgoing r'ship
FOUND_INto/from Acmella Paniculata (Plant) Rel Props:Reference: - 3. Outgoing r'ship
FOUND_INto/from Acypha Paniculata (Plant) Rel Props:Reference: - 4. Outgoing r'ship
FOUND_INto/from Afraegle Paniculata (Plant) Rel Props:Reference: - 5. Outgoing r'ship
FOUND_INto/from Ageratum Conyzoides (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 6. Outgoing r'ship
FOUND_INto/from Ageratum Houstonianum (Plant) Rel Props:Reference: - 7. Outgoing r'ship
FOUND_INto/from Ageratum Mexicanum (Plant) Rel Props:Reference: - 8. Outgoing r'ship
FOUND_INto/from Andrographis Paniculata (Plant) Rel Props:Reference: - 9. Outgoing r'ship
FOUND_INto/from Ardisia Paniculata (Plant) Rel Props:Reference: - 10. Outgoing r'ship
FOUND_INto/from Bauhinia Acuminata (Plant) Rel Props:Reference: - 11. Outgoing r'ship
FOUND_INto/from Bauhinia Championii (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 12. Outgoing r'ship
FOUND_INto/from Bauhinia Divaricata (Plant) Rel Props:Reference: - 13. Outgoing r'ship
FOUND_INto/from Bauhinia Ichii (Plant) Rel Props:Reference: - 14. Outgoing r'ship
FOUND_INto/from Bauhinia Malabarica (Plant) Rel Props:Reference: - 15. Outgoing r'ship
FOUND_INto/from Bauhinia Monandra (Plant) Rel Props:Reference: - 16. Outgoing r'ship
FOUND_INto/from Bauhinia Phoenicea (Plant) Rel Props:Reference: - 17. Outgoing r'ship
FOUND_INto/from Bauhinia Purpurea (Plant) Rel Props:Reference: - 18. Outgoing r'ship
FOUND_INto/from Bauhinia Racemosa (Plant) Rel Props:Reference: - 19. Outgoing r'ship
FOUND_INto/from Bauhinia Retusa (Plant) Rel Props:Reference: - 20. Outgoing r'ship
FOUND_INto/from Bauhinia Roxburghiana (Plant) Rel Props:Reference: - 21. Outgoing r'ship
FOUND_INto/from Bauhinia Rufescens (Plant) Rel Props:Reference: - 22. Outgoing r'ship
FOUND_INto/from Bauhinia Scandens (Plant) Rel Props:Reference: - 23. Outgoing r'ship
FOUND_INto/from Bauhinia Semla (Plant) Rel Props:Reference: - 24. Outgoing r'ship
FOUND_INto/from Bauhinia Tomentosa (Plant) Rel Props:Reference: - 25. Outgoing r'ship
FOUND_INto/from Bauhinia Vahlii (Plant) Rel Props:Reference: - 26. Outgoing r'ship
FOUND_INto/from Bauhinia Variagata (Plant) Rel Props:Reference: - 27. Outgoing r'ship
FOUND_INto/from Bauhinia Variegata (Plant) Rel Props:Reference: - 28. Outgoing r'ship
FOUND_INto/from Blumea Axillaris (Plant) Rel Props:Reference: - 29. Outgoing r'ship
FOUND_INto/from Blumea Balsamifera (Plant) Rel Props:Reference: - 30. Outgoing r'ship
FOUND_INto/from Blumea Bifoliata (Plant) Rel Props:Reference: - 31. Outgoing r'ship
FOUND_INto/from Blumea Chinensis (Plant) Rel Props:Reference: - 32. Outgoing r'ship
FOUND_INto/from Blumea Densiflora (Plant) Rel Props:Reference: - 33. Outgoing r'ship
FOUND_INto/from Blumea Dregeanoides (Plant) Rel Props:Reference: - 34. Outgoing r'ship
FOUND_INto/from Blumea Eriantha (Plant) Rel Props:Reference: - 35. Outgoing r'ship
FOUND_INto/from Blumea Erientha (Plant) Rel Props:Reference: - 36. Outgoing r'ship
FOUND_INto/from Blumea Fistulosa (Plant) Rel Props:Reference: - 37. Outgoing r'ship
FOUND_INto/from Blumea Glomerata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 38. Outgoing r'ship
FOUND_INto/from Blumea Hieracifolia (Plant) Rel Props:Reference: - 39. Outgoing r'ship
FOUND_INto/from Blumea Lacera (Plant) Rel Props:Reference: - 40. Outgoing r'ship
FOUND_INto/from Blumea Laciniata (Plant) Rel Props:Reference: - 41. Outgoing r'ship
FOUND_INto/from Blumea Lanceolaria (Plant) Rel Props:Reference: - 42. Outgoing r'ship
FOUND_INto/from Blumea Malcolmii (Plant) Rel Props:Reference: - 43. Outgoing r'ship
FOUND_INto/from Blumea Membranacea (Plant) Rel Props:Reference: - 44. Outgoing r'ship
FOUND_INto/from Blumea Mollis (Plant) Rel Props:Reference: - 45. Outgoing r'ship
FOUND_INto/from Blumea Obliqua (Plant) Rel Props:Reference: - 46. Outgoing r'ship
FOUND_INto/from Blumea Odorata (Plant) Rel Props:Reference: - 47. Outgoing r'ship
FOUND_INto/from Blumea Oxyodonta (Plant) Rel Props:Reference: - 48. Outgoing r'ship
FOUND_INto/from Blumea Riparia (Plant) Rel Props:Reference: - 49. Outgoing r'ship
FOUND_INto/from Blumea Sessiliflora (Plant) Rel Props:Reference: - 50. Outgoing r'ship
FOUND_INto/from Blumea Virens (Plant) Rel Props:Reference: - 51. Outgoing r'ship
FOUND_INto/from Blumea Viscosa (Plant) Rel Props:Reference: - 52. Outgoing r'ship
FOUND_INto/from Blumea Wightiana (Plant) Rel Props:Reference: - 53. Outgoing r'ship
FOUND_INto/from Carpha Glomerata (Plant) Rel Props:Reference: - 54. Outgoing r'ship
FOUND_INto/from Cassine Paniculata (Plant) Rel Props:Reference: - 55. Outgoing r'ship
FOUND_INto/from Chenopodium Championii (Plant) Rel Props:Reference: - 56. Outgoing r'ship
FOUND_INto/from Citrus Acida (Plant) Rel Props:Reference: - 57. Outgoing r'ship
FOUND_INto/from Citrus Aurantifolia (Plant) Rel Props:Reference: - 58. Outgoing r'ship
FOUND_INto/from Citrus Aurantiifolia (Plant) Rel Props:Reference: - 59. Outgoing r'ship
FOUND_INto/from Citrus Aurantium (Plant) Rel Props:Reference: - 60. Outgoing r'ship
FOUND_INto/from Citrus Bergamia (Plant) Rel Props:Reference: - 61. Outgoing r'ship
FOUND_INto/from Citrus Chachiensis (Plant) Rel Props:Reference: - 62. Outgoing r'ship
FOUND_INto/from Citrus Decumana (Plant) Rel Props:Reference: - 63. Outgoing r'ship
FOUND_INto/from Citrus Erythrosa (Plant) Rel Props:Reference: - 64. Outgoing r'ship
FOUND_INto/from Citrus Funadoko (Plant) Rel Props:Reference: - 65. Outgoing r'ship
FOUND_INto/from Citrus Glauca (Plant) Rel Props:Reference: - 66. Outgoing r'ship
FOUND_INto/from Citrus Grandis (Plant) Rel Props:Reference: - 67. Outgoing r'ship
FOUND_INto/from Citrus Hassaku (Plant) Rel Props:Reference: - 68. Outgoing r'ship
FOUND_INto/from Citrus Hybr (Plant) Rel Props:Reference: - 69. Outgoing r'ship
FOUND_INto/from Citrus Hystrix (Plant) Rel Props:Reference: - 70. Outgoing r'ship
FOUND_INto/from Citrus Indica (Plant) Rel Props:Reference: - 71. Outgoing r'ship
FOUND_INto/from Citrus Jambhiri (Plant) Rel Props:Reference: - 72. Outgoing r'ship
FOUND_INto/from Citrus Japonica (Plant) Rel Props:Reference: - 73. Outgoing r'ship
FOUND_INto/from Citrus Junos (Plant) Rel Props:Reference: - 74. Outgoing r'ship
FOUND_INto/from Citrus Latifolia (Plant) Rel Props:Reference: - 75. Outgoing r'ship
FOUND_INto/from Citrus Latipes (Plant) Rel Props:Reference: - 76. Outgoing r'ship
FOUND_INto/from Citrus Limon (Plant) Rel Props:Reference: - 77. Outgoing r'ship
FOUND_INto/from Citrus Limonia (Plant) Rel Props:Reference: - 78. Outgoing r'ship
FOUND_INto/from Citrus Maxima (Plant) Rel Props:Reference: - 79. Outgoing r'ship
FOUND_INto/from Citrus Medica (Plant) Rel Props:Reference: - 80. Outgoing r'ship
FOUND_INto/from Citrus Mitis (Plant) Rel Props:Reference: - 81. Outgoing r'ship
FOUND_INto/from Citrus Natsudaidai (Plant) Rel Props:Reference: - 82. Outgoing r'ship
FOUND_INto/from Citrus Nobilis (Plant) Rel Props:Reference: - 83. Outgoing r'ship
FOUND_INto/from Citrus Paradisi (Plant) Rel Props:Reference:https://doi.org/10.15482/usda.adc/1239279 - 84. Outgoing r'ship
FOUND_INto/from Citrus Pennivesiculata (Plant) Rel Props:Reference: - 85. Outgoing r'ship
FOUND_INto/from Citrus Pseudolimon (Plant) Rel Props:Reference: - 86. Outgoing r'ship
FOUND_INto/from Citrus Reshni (Plant) Rel Props:Reference: - 87. Outgoing r'ship
FOUND_INto/from Citrus Reticulata (Plant) Rel Props:Reference: - 88. Outgoing r'ship
FOUND_INto/from Citrus Reticulate (Plant) Rel Props:Source_db:npass_chem_all - 89. Outgoing r'ship
FOUND_INto/from Citrus Rugulosa (Plant) Rel Props:Reference: - 90. Outgoing r'ship
FOUND_INto/from Citrus Sinensis (Plant) Rel Props:Reference: - 91. Outgoing r'ship
FOUND_INto/from Citrus Sudachii (Plant) Rel Props:Reference: - 92. Outgoing r'ship
FOUND_INto/from Citrus Tachibana (Plant) Rel Props:Reference: - 93. Outgoing r'ship
FOUND_INto/from Citrus Tamurana (Plant) Rel Props:Reference: - 94. Outgoing r'ship
FOUND_INto/from Citrus Tangemna (Plant) Rel Props:Reference: - 95. Outgoing r'ship
FOUND_INto/from Citrus Tangerina (Plant) Rel Props:Reference: - 96. Outgoing r'ship
FOUND_INto/from Citrus Tankan (Plant) Rel Props:Reference: - 97. Outgoing r'ship
FOUND_INto/from Citrus Trifoliata (Plant) Rel Props:Reference: - 98. Outgoing r'ship
FOUND_INto/from Citrus Unshiu (Plant) Rel Props:Reference: - 99. Outgoing r'ship
FOUND_INto/from Citrus Wilsonii (Plant) Rel Props:Reference: - 100. Outgoing r'ship
FOUND_INto/from Citrus X (Plant) Rel Props:Reference: - 101. Outgoing r'ship
FOUND_INto/from Citrus Yuko (Plant) Rel Props:Reference: - 102. Outgoing r'ship
FOUND_INto/from Coussarea Paniculata (Plant) Rel Props:Reference: - 103. Outgoing r'ship
FOUND_INto/from Crotalaria Paniculata (Plant) Rel Props:Reference: - 104. Outgoing r'ship
FOUND_INto/from Dactylis Glomerata (Plant) Rel Props:Reference: - 105. Outgoing r'ship
FOUND_INto/from Dalbergia Lanceolaria (Plant) Rel Props:Reference: - 106. Outgoing r'ship
FOUND_INto/from Datisca Glomerata (Plant) Rel Props:Reference: - 107. Outgoing r'ship
FOUND_INto/from Dbergia Paniculata (Plant) Rel Props:Reference: - 108. Outgoing r'ship
FOUND_INto/from Diospyros Paniculata (Plant) Rel Props:Reference: - 109. Outgoing r'ship
FOUND_INto/from Dryopteris Championii (Plant) Rel Props:Reference: - 110. Outgoing r'ship
FOUND_INto/from Erycibe Paniculata (Plant) Rel Props:Reference: - 111. Outgoing r'ship
FOUND_INto/from Ethulia Conyzoides (Plant) Rel Props:Reference: - 112. Outgoing r'ship
FOUND_INto/from Ficus Glomerata (Plant) Rel Props:Reference: - 113. Outgoing r'ship
FOUND_INto/from Flemingia Paniculata (Plant) Rel Props:Reference: - 114. Outgoing r'ship
FOUND_INto/from Gymnacranthera Paniculata (Plant) Rel Props:Reference: - 115. Outgoing r'ship
FOUND_INto/from Hydrangea Paniculata (Plant) Rel Props:Reference: - 116. Outgoing r'ship
FOUND_INto/from Ipomoea Paniculata (Plant) Rel Props:Reference: - 117. Outgoing r'ship
FOUND_INto/from Jacquemontia Paniculata (Plant) Rel Props:Reference: - 118. Outgoing r'ship
FOUND_INto/from Justicia Paniculata (Plant) Rel Props:Reference: - 119. Outgoing r'ship
FOUND_INto/from Koelreuteria Paniculata (Plant) Rel Props:Reference: - 120. Outgoing r'ship
FOUND_INto/from Meconopsis Paniculata (Plant) Rel Props:Reference: - 121. Outgoing r'ship
FOUND_INto/from Microcos Paniculata (Plant) Rel Props:Reference: - 122. Outgoing r'ship
FOUND_INto/from Murraya Alata (Plant) Rel Props:Reference: - 123. Outgoing r'ship
FOUND_INto/from Murraya Crenulata (Plant) Rel Props:Reference: - 124. Outgoing r'ship
FOUND_INto/from Murraya Elongata (Plant) Rel Props:Reference: - 125. Outgoing r'ship
FOUND_INto/from Murraya Euchrestifolia (Plant) Rel Props:Reference: - 126. Outgoing r'ship
FOUND_INto/from Murraya Exotica (Plant) Rel Props:Reference: - 127. Outgoing r'ship
FOUND_INto/from Murraya Koenigii (Plant) Rel Props:Reference: - 128. Outgoing r'ship
FOUND_INto/from Murraya Kwangsiensis (Plant) Rel Props:Reference: - 129. Outgoing r'ship
FOUND_INto/from Murraya Microphylla (Plant) Rel Props:Reference: - 130. Outgoing r'ship
FOUND_INto/from Murraya Paniculata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 131. Outgoing r'ship
FOUND_INto/from Murraya Siamensis (Plant) Rel Props:Reference: - 132. Outgoing r'ship
FOUND_INto/from Onosma Paniculata (Plant) Rel Props:Reference: - 133. Outgoing r'ship
FOUND_INto/from Ostodes Paniculata (Plant) Rel Props:Reference: - 134. Outgoing r'ship
FOUND_INto/from Oxyspora Paniculata (Plant) Rel Props:Reference: - 135. Outgoing r'ship
FOUND_INto/from Picris Conyzoides (Plant) Rel Props:Reference: - 136. Outgoing r'ship
FOUND_INto/from Polygala Glomerata (Plant) Rel Props:Reference: - 137. Outgoing r'ship
FOUND_INto/from Porana Paniculata (Plant) Rel Props:Reference: - 138. Outgoing r'ship
FOUND_INto/from Sasa Paniculata (Plant) Rel Props:Reference: - 139. Outgoing r'ship
FOUND_INto/from Spilanthes Paniculata (Plant) Rel Props:Reference: - 140. Outgoing r'ship
FOUND_INto/from Stevia Paniculata (Plant) Rel Props:Reference: - 141. Outgoing r'ship
FOUND_INto/from Swertia Paniculata (Plant) Rel Props:Reference: - 142. Outgoing r'ship
FOUND_INto/from Symplocos Glomerata (Plant) Rel Props:Reference: - 143. Outgoing r'ship
FOUND_INto/from Symplocos Paniculata (Plant) Rel Props:Reference: - 144. Outgoing r'ship
FOUND_INto/from Terminalia Paniculata (Plant) Rel Props:Reference: - 145. Outgoing r'ship
FOUND_INto/from Vitex Paniculata (Plant) Rel Props:Reference: - 146. Outgoing r'ship
FOUND_INto/from Wendlandia Paniculata (Plant) Rel Props:Reference: