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Heveaflavone

PubChem CID: 15559724

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Compound Synonyms HEVEAFLAVONE, 23132-13-0, 5-hydroxy-8-[2-hydroxy-5-(5-hydroxy-7-methoxy-4-oxochromen-2-yl)phenyl]-7-methoxy-2-(4-methoxyphenyl)chromen-4-one, 4H-1-Benzopyran-4-one, 5-hydroxy-8-[2-hydroxy-5-(5-hydroxy-7-methoxy-4-oxo-4H-1-benzopyran-2-yl)phenyl]-7-methoxy-2-(4-methoxyphenyl)-, 3''',8-Biflavone, 4''',5,5''-trihydroxy-4',7,7''-trimethoxy- (8CI), 5-Hydroxy-8-[2-hydroxy-5-(5-hydroxy-7-methoxy-4-oxo-4H-1-benzopyran-2-yl)phenyl]-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one, 5-hydroxy-8-(2-hydroxy-5-(5-hydroxy-7-methoxy-4-oxo-4H-chromen-2-yl)phenyl)-7-methoxy-2-(4-methoxyphenyl)-4H-chromen-4-one, 5-hydroxy-8-(2-hydroxy-5-(5-hydroxy-7-methoxy-4-oxochromen-2-yl)phenyl)-7-methoxy-2-(4-methoxyphenyl)chromen-4-one, HY-N4047, YAA13213, AKOS032948160, FS-9629, DA-53958, CS-0024527, B0005-175502
Ghose Rule False
Classyfire Kingdom Organic compounds
Topological Polar Surface Area 141.0
Hydrogen Bond Donor Count 3.0
Pfizer 3 75 Rule False
Scaffold Graph Level CC1CC(C2CCCC(C3CCCC4C(C)CC(C5CCCCC5)CC43)C2)CC2CCCCC12
Np Classifier Class Flavones
Deep Smiles COcccccc6))ccc=O)cco6)cccc6O)))OC)))cccccc6O))))ccc=O)cco6)cccc6O)))OC
Heavy Atom Count 43.0
Classyfire Class Flavonoids
Scaffold Graph Node Level OC1CC(C2CCCC(C3CCCC4C(O)CC(C5CCCCC5)OC43)C2)OC2CCCCC12
Classyfire Subclass Biflavonoids and polyflavonoids
Isotope Atom Count 0.0
Molecular Complexity 1100.0
Database Name cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Uniprot Id P56817, n.a., P05067
Iupac Name 5-hydroxy-8-[2-hydroxy-5-(5-hydroxy-7-methoxy-4-oxochromen-2-yl)phenyl]-7-methoxy-2-(4-methoxyphenyl)chromen-4-one
Prediction Hob 0.0
Veber Rule False
Classyfire Superclass Phenylpropanoids and polyketides
Xlogp 6.0
Gsk 4 400 Rule False
Molecular Formula C33H24O10
Scaffold Graph Node Bond Level O=c1cc(-c2cccc(-c3cccc4c(=O)cc(-c5ccccc5)oc34)c2)oc2ccccc12
Prediction Swissadme 0.0
Inchi Key NXPAGAZHSWSUFJ-UHFFFAOYSA-N
Silicos It Class Insoluble
Fcsp3 0.0909090909090909
Logs -5.101
Rotatable Bond Count 6.0
Logd 2.579
Synonyms heveaflavone
Esol Class Poorly soluble
Functional Groups c=O, cO, cOC, coc
Compound Name Heveaflavone
Prediction Hob Swissadme 0.0
Exact Mass 580.137
Formal Charge 0.0
Monoisotopic Mass 580.137
Hydrogen Bond Acceptor Count 10.0
Molecular Weight 580.5
Gi Absorption False
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 0.0
Lipinski Rule Of 5 False
Esol -6.391276674418607
Inchi InChI=1S/C33H24O10/c1-39-18-7-4-16(5-8-18)26-14-24(37)32-25(38)15-28(41-3)30(33(32)43-26)20-10-17(6-9-21(20)34)27-13-23(36)31-22(35)11-19(40-2)12-29(31)42-27/h4-15,34-35,38H,1-3H3
Smiles COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3O)OC)C4=C(C=CC(=C4)C5=CC(=O)C6=C(C=C(C=C6O5)OC)O)O
Nring 6.0
Np Classifier Biosynthetic Pathway Shikimates and Phenylpropanoids
Defined Bond Stereocenter Count 0.0
Egan Rule False
Np Classifier Superclass Flavonoids

  • 1. Outgoing r'ship FOUND_IN to/from Acacia Lemmoni (Plant) Rel Props:Reference:
  • 2. Outgoing r'ship FOUND_IN to/from Aerva Javanica (Plant) Rel Props:Source_db:npass_chem_all
  • 3. Outgoing r'ship FOUND_IN to/from Aerva Koenigii (Plant) Rel Props:Reference:
  • 4. Outgoing r'ship FOUND_IN to/from Aerva Lanata (Plant) Rel Props:Reference:
  • 5. Outgoing r'ship FOUND_IN to/from Aerva Monsonia (Plant) Rel Props:Reference:
  • 6. Outgoing r'ship FOUND_IN to/from Aerva Persica (Plant) Rel Props:Reference:
  • 7. Outgoing r'ship FOUND_IN to/from Aerva Sanguinolenta (Plant) Rel Props:Reference:
  • 8. Outgoing r'ship FOUND_IN to/from Aerva Wightii (Plant) Rel Props:Reference:
  • 9. Outgoing r'ship FOUND_IN to/from Andrographis Herba (Plant) Rel Props:Reference:
  • 10. Outgoing r'ship FOUND_IN to/from Argyrcia Nervosa (Plant) Rel Props:Reference:
  • 11. Outgoing r'ship FOUND_IN to/from Argyreia Nervosa (Plant) Rel Props:Reference:
  • 12. Outgoing r'ship FOUND_IN to/from Bischofia Javanica (Plant) Rel Props:Reference:
  • 13. Outgoing r'ship FOUND_IN to/from Bletilla Striata (Plant) Rel Props:Reference:
  • 14. Outgoing r'ship FOUND_IN to/from Brucea Javanica (Plant) Rel Props:Reference:
  • 15. Outgoing r'ship FOUND_IN to/from Cassia Javanica (Plant) Rel Props:Reference:
  • 16. Outgoing r'ship FOUND_IN to/from Ceanothus Integerrimus (Plant) Rel Props:Reference:
  • 17. Outgoing r'ship FOUND_IN to/from Cissus Adnata (Plant) Rel Props:Reference:
  • 18. Outgoing r'ship FOUND_IN to/from Cissus Arnottiana (Plant) Rel Props:Reference:
  • 19. Outgoing r'ship FOUND_IN to/from Cissus Javanica (Plant) Rel Props:Reference:
  • 20. Outgoing r'ship FOUND_IN to/from Cissus Latifolia (Plant) Rel Props:Reference:
  • 21. Outgoing r'ship FOUND_IN to/from Cissus Maida (Plant) Rel Props:Reference:
  • 22. Outgoing r'ship FOUND_IN to/from Cissus Pallidiflorus (Plant) Rel Props:Reference:
  • 23. Outgoing r'ship FOUND_IN to/from Cissus Quadrangularis (Plant) Rel Props:Reference:
  • 24. Outgoing r'ship FOUND_IN to/from Cissus Quinquefolia (Plant) Rel Props:Reference:
  • 25. Outgoing r'ship FOUND_IN to/from Cissus Repanda (Plant) Rel Props:Reference:
  • 26. Outgoing r'ship FOUND_IN to/from Cissus Repens (Plant) Rel Props:Reference:
  • 27. Outgoing r'ship FOUND_IN to/from Cissus Tricuspidata (Plant) Rel Props:Reference:
  • 28. Outgoing r'ship FOUND_IN to/from Cissus Vitiginea (Plant) Rel Props:Reference:
  • 29. Outgoing r'ship FOUND_IN to/from Cnesmone Javanica (Plant) Rel Props:Reference:
  • 30. Outgoing r'ship FOUND_IN to/from Corydalis Bungeanae (Plant) Rel Props:Reference:
  • 31. Outgoing r'ship FOUND_IN to/from Cytisus Austriacus (Plant) Rel Props:Reference:
  • 32. Outgoing r'ship FOUND_IN to/from Cytisus Caramanicus (Plant) Rel Props:Reference:
  • 33. Outgoing r'ship FOUND_IN to/from Cytisus Ciliatus (Plant) Rel Props:Reference:
  • 34. Outgoing r'ship FOUND_IN to/from Cytisus Ratisbonensis (Plant) Rel Props:Reference:
  • 35. Outgoing r'ship FOUND_IN to/from Cytisus Scoparius (Plant) Rel Props:Reference:
  • 36. Outgoing r'ship FOUND_IN to/from Emilia Javanica (Plant) Rel Props:Reference:
  • 37. Outgoing r'ship FOUND_IN to/from Ephedra Herba (Plant) Rel Props:Reference:
  • 38. Outgoing r'ship FOUND_IN to/from Eremurus Chinensis (Plant) Rel Props:Reference:
  • 39. Outgoing r'ship FOUND_IN to/from Eremurus Himalaicus (Plant) Rel Props:Reference:
  • 40. Outgoing r'ship FOUND_IN to/from Etlingera Elatior (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 41. Outgoing r'ship FOUND_IN to/from Etlingera Linguiformis (Plant) Rel Props:Reference:
  • 42. Outgoing r'ship FOUND_IN to/from Ficus Nervosa (Plant) Rel Props:Reference:
  • 43. Outgoing r'ship FOUND_IN to/from Garcinia Nervosa (Plant) Rel Props:Reference:
  • 44. Outgoing r'ship FOUND_IN to/from Hedyotis Diffusae (Plant) Rel Props:Reference:
  • 45. Outgoing r'ship FOUND_IN to/from Hevea Brasiliensis (Plant) Rel Props:Reference:ISBN:9788172360481; ISBN:9788185042053
  • 46. Outgoing r'ship FOUND_IN to/from Hydrocotyle Javanica (Plant) Rel Props:Reference:
  • 47. Outgoing r'ship FOUND_IN to/from Hymenoxys Grandiflora (Plant) Rel Props:Reference:
  • 48. Outgoing r'ship FOUND_IN to/from Hymenoxys Insignis (Plant) Rel Props:Reference:
  • 49. Outgoing r'ship FOUND_IN to/from Hymenoxys Ivesiana (Plant) Rel Props:Reference:
  • 50. Outgoing r'ship FOUND_IN to/from Hymenoxys Microcephala (Plant) Rel Props:Reference:
  • 51. Outgoing r'ship FOUND_IN to/from Hymenoxys Odorata (Plant) Rel Props:Reference:
  • 52. Outgoing r'ship FOUND_IN to/from Hymenoxys Scaposa (Plant) Rel Props:Reference:
  • 53. Outgoing r'ship FOUND_IN to/from Inula Nervosa (Plant) Rel Props:Reference:
  • 54. Outgoing r'ship FOUND_IN to/from Ixora Javanica (Plant) Rel Props:Reference:
  • 55. Outgoing r'ship FOUND_IN to/from Jackiella Javanica (Plant) Rel Props:Reference:
  • 56. Outgoing r'ship FOUND_IN to/from Kummerowia Striata (Plant) Rel Props:Reference:
  • 57. Outgoing r'ship FOUND_IN to/from Liparis Nervosa (Plant) Rel Props:Reference:
  • 58. Outgoing r'ship FOUND_IN to/from Lippia Javanica (Plant) Rel Props:Reference:
  • 59. Outgoing r'ship FOUND_IN to/from Lychnophora Columnaris (Plant) Rel Props:Reference:
  • 60. Outgoing r'ship FOUND_IN to/from Lychnophora Pinaster (Plant) Rel Props:Reference:
  • 61. Outgoing r'ship FOUND_IN to/from Mundulea Striata (Plant) Rel Props:Reference:
  • 62. Outgoing r'ship FOUND_IN to/from Nageia Wallichiana (Plant) Rel Props:Reference:ISBN:9788172362461; ISBN:9788185042145
  • 63. Outgoing r'ship FOUND_IN to/from Oenanthe Javanica (Plant) Rel Props:Reference:
  • 64. Outgoing r'ship FOUND_IN to/from Opuntia Elatior (Plant) Rel Props:Reference:
  • 65. Outgoing r'ship FOUND_IN to/from Paranephelius Uniflorus (Plant) Rel Props:Reference:
  • 66. Outgoing r'ship FOUND_IN to/from Parkia Javanica (Plant) Rel Props:Reference:
  • 67. Outgoing r'ship FOUND_IN to/from Pedicularis Striata (Plant) Rel Props:Reference:
  • 68. Outgoing r'ship FOUND_IN to/from Picrasma Javanica (Plant) Rel Props:Reference:
  • 69. Outgoing r'ship FOUND_IN to/from Pinus Aristata (Plant) Rel Props:Reference:
  • 70. Outgoing r'ship FOUND_IN to/from Pinus Armandii (Plant) Rel Props:Reference:
  • 71. Outgoing r'ship FOUND_IN to/from Pinus Banksiana (Plant) Rel Props:Reference:
  • 72. Outgoing r'ship FOUND_IN to/from Pinus Brutia (Plant) Rel Props:Reference:
  • 73. Outgoing r'ship FOUND_IN to/from Pinus Bungeana (Plant) Rel Props:Reference:
  • 74. Outgoing r'ship FOUND_IN to/from Pinus Canariensis (Plant) Rel Props:Reference:
  • 75. Outgoing r'ship FOUND_IN to/from Pinus Cembra (Plant) Rel Props:Reference:
  • 76. Outgoing r'ship FOUND_IN to/from Pinus Densiflora (Plant) Rel Props:Reference:
  • 77. Outgoing r'ship FOUND_IN to/from Pinus Edulis (Plant) Rel Props:Reference:
  • 78. Outgoing r'ship FOUND_IN to/from Pinus Elliottii (Plant) Rel Props:Reference:
  • 79. Outgoing r'ship FOUND_IN to/from Pinus Excelsa (Plant) Rel Props:Reference:
  • 80. Outgoing r'ship FOUND_IN to/from Pinus Flexilis (Plant) Rel Props:Reference:
  • 81. Outgoing r'ship FOUND_IN to/from Pinus Gerardiana (Plant) Rel Props:Reference:
  • 82. Outgoing r'ship FOUND_IN to/from Pinus Glauca (Plant) Rel Props:Reference:
  • 83. Outgoing r'ship FOUND_IN to/from Pinus Griffithi (Plant) Rel Props:Reference:
  • 84. Outgoing r'ship FOUND_IN to/from Pinus Halepensis (Plant) Rel Props:Reference:
  • 85. Outgoing r'ship FOUND_IN to/from Pinus Heldreichii (Plant) Rel Props:Reference:
  • 86. Outgoing r'ship FOUND_IN to/from Pinus Kesiya (Plant) Rel Props:Reference:
  • 87. Outgoing r'ship FOUND_IN to/from Pinus Koraiensis (Plant) Rel Props:Reference:
  • 88. Outgoing r'ship FOUND_IN to/from Pinus Krempfii (Plant) Rel Props:Reference:
  • 89. Outgoing r'ship FOUND_IN to/from Pinus Longifolia (Plant) Rel Props:Reference:
  • 90. Outgoing r'ship FOUND_IN to/from Pinus Massoniana (Plant) Rel Props:Reference:
  • 91. Outgoing r'ship FOUND_IN to/from Pinus Merkusii (Plant) Rel Props:Reference:
  • 92. Outgoing r'ship FOUND_IN to/from Pinus Monophylla (Plant) Rel Props:Reference:
  • 93. Outgoing r'ship FOUND_IN to/from Pinus Monticola (Plant) Rel Props:Reference:
  • 94. Outgoing r'ship FOUND_IN to/from Pinus Mugo (Plant) Rel Props:Reference:
  • 95. Outgoing r'ship FOUND_IN to/from Pinus Palustris (Plant) Rel Props:Reference:
  • 96. Outgoing r'ship FOUND_IN to/from Pinus Picea (Plant) Rel Props:Reference:
  • 97. Outgoing r'ship FOUND_IN to/from Pinus Pinaster (Plant) Rel Props:Reference:
  • 98. Outgoing r'ship FOUND_IN to/from Pinus Pumila (Plant) Rel Props:Reference:
  • 99. Outgoing r'ship FOUND_IN to/from Pinus Radiata (Plant) Rel Props:Reference:
  • 100. Outgoing r'ship FOUND_IN to/from Pinus Resinosa (Plant) Rel Props:Reference:
  • 101. Outgoing r'ship FOUND_IN to/from Pinus Rigida (Plant) Rel Props:Reference:
  • 102. Outgoing r'ship FOUND_IN to/from Pinus Roxburghii (Plant) Rel Props:Reference:
  • 103. Outgoing r'ship FOUND_IN to/from Pinus Sibirica (Plant) Rel Props:Reference:
  • 104. Outgoing r'ship FOUND_IN to/from Pinus Sitchensis (Plant) Rel Props:Reference:
  • 105. Outgoing r'ship FOUND_IN to/from Pinus Strobus (Plant) Rel Props:Reference:
  • 106. Outgoing r'ship FOUND_IN to/from Pinus Sylvestris (Plant) Rel Props:Reference:
  • 107. Outgoing r'ship FOUND_IN to/from Pinus Taeda (Plant) Rel Props:Reference:
  • 108. Outgoing r'ship FOUND_IN to/from Pinus Thunbergii (Plant) Rel Props:Reference:
  • 109. Outgoing r'ship FOUND_IN to/from Pinus Wallichiana (Plant) Rel Props:Reference:
  • 110. Outgoing r'ship FOUND_IN to/from Pinus Yunnanensis (Plant) Rel Props:Reference:
  • 111. Outgoing r'ship FOUND_IN to/from Primula Elatior (Plant) Rel Props:Reference:
  • 112. Outgoing r'ship FOUND_IN to/from Psidium Acutangulum (Plant) Rel Props:Reference:
  • 113. Outgoing r'ship FOUND_IN to/from Psidium Guajava (Plant) Rel Props:Reference:
  • 114. Outgoing r'ship FOUND_IN to/from Pteris Cretica (Plant) Rel Props:Reference:
  • 115. Outgoing r'ship FOUND_IN to/from Rabdosia Nervosa (Plant) Rel Props:Reference:
  • 116. Outgoing r'ship FOUND_IN to/from Rhus Javanica (Plant) Rel Props:Reference:
  • 117. Outgoing r'ship FOUND_IN to/from Sambucus Javanica (Plant) Rel Props:Reference:
  • 118. Outgoing r'ship FOUND_IN to/from Selaginella Apoda (Plant) Rel Props:Reference:
  • 119. Outgoing r'ship FOUND_IN to/from Selaginella Braunii (Plant) Rel Props:Reference:
  • 120. Outgoing r'ship FOUND_IN to/from Selaginella Bryopteris (Plant) Rel Props:Reference:
  • 121. Outgoing r'ship FOUND_IN to/from Selaginella Chrysocaulos (Plant) Rel Props:Reference:
  • 122. Outgoing r'ship FOUND_IN to/from Selaginella Davidii (Plant) Rel Props:Reference:
  • 123. Outgoing r'ship FOUND_IN to/from Selaginella Doederleinii (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 124. Outgoing r'ship FOUND_IN to/from Selaginella Involvens (Plant) Rel Props:Reference:
  • 125. Outgoing r'ship FOUND_IN to/from Selaginella Labordei (Plant) Rel Props:Reference:
  • 126. Outgoing r'ship FOUND_IN to/from Selaginella Moellendorffii (Plant) Rel Props:Reference:
  • 127. Outgoing r'ship FOUND_IN to/from Selaginella Monosperma (Plant) Rel Props:Reference:
  • 128. Outgoing r'ship FOUND_IN to/from Selaginella Omeiensis (Plant) Rel Props:Reference:
  • 129. Outgoing r'ship FOUND_IN to/from Selaginella Pulvinata (Plant) Rel Props:Reference:
  • 130. Outgoing r'ship FOUND_IN to/from Selaginella Radicata (Plant) Rel Props:Reference:
  • 131. Outgoing r'ship FOUND_IN to/from Selaginella Repanda (Plant) Rel Props:Reference:
  • 132. Outgoing r'ship FOUND_IN to/from Selaginella Rupestris (Plant) Rel Props:Reference:
  • 133. Outgoing r'ship FOUND_IN to/from Selaginella Sanguinolenta (Plant) Rel Props:Reference:
  • 134. Outgoing r'ship FOUND_IN to/from Selaginella Semicordata (Plant) Rel Props:Reference:
  • 135. Outgoing r'ship FOUND_IN to/from Selaginella Sinensis (Plant) Rel Props:Reference:
  • 136. Outgoing r'ship FOUND_IN to/from Selaginella Stauntoniana (Plant) Rel Props:Reference:
  • 137. Outgoing r'ship FOUND_IN to/from Selaginella Tamariscina (Plant) Rel Props:Reference:
  • 138. Outgoing r'ship FOUND_IN to/from Selaginella Uncinata (Plant) Rel Props:Reference:
  • 139. Outgoing r'ship FOUND_IN to/from Senecio Integerrimus (Plant) Rel Props:Reference:
  • 140. Outgoing r'ship FOUND_IN to/from Sesbania Javanica (Plant) Rel Props:Reference:
  • 141. Outgoing r'ship FOUND_IN to/from Sterculia Lychnophora (Plant) Rel Props:Reference:
  • 142. Outgoing r'ship FOUND_IN to/from Swertia Nervosa (Plant) Rel Props:Reference:
  • 143. Outgoing r'ship FOUND_IN to/from Uncaria Nervosa (Plant) Rel Props:Reference:
  • 144. Outgoing r'ship FOUND_IN to/from Wrightia Javanica (Plant) Rel Props:Reference:
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