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4-[(2R)-8-(2-hydroxyethyl)-7-methoxy-3,4-dihydro-2H-chromen-2-yl]benzene-1,3-diol

PubChem CID: 53468592

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Compound Synonyms CHEMBL1951301, BDBM50364139
Topological Polar Surface Area 79.2
Hydrogen Bond Donor Count 3.0
Heavy Atom Count 23.0
Isotope Atom Count 0.0
Molecular Complexity 376.0
Database Name cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count 1.0
Uniprot Id O42713, n.a.
Iupac Name 4-[(2R)-8-(2-hydroxyethyl)-7-methoxy-3,4-dihydro-2H-chromen-2-yl]benzene-1,3-diol
Prediction Hob 1.0
Xlogp 2.7
Molecular Formula C18H20O5
Prediction Swissadme 1.0
Inchi Key BJVDGVPUXJNXHR-QGZVFWFLSA-N
Fcsp3 0.3333333333333333
Logs -3.174
Rotatable Bond Count 4.0
Logd 2.178
Compound Name 4-[(2R)-8-(2-hydroxyethyl)-7-methoxy-3,4-dihydro-2H-chromen-2-yl]benzene-1,3-diol
Prediction Hob Swissadme 1.0
Exact Mass 316.131
Formal Charge 0.0
Monoisotopic Mass 316.131
Hydrogen Bond Acceptor Count 5.0
Molecular Weight 316.3
Covalent Unit Count 1.0
Total Atom Stereocenter Count 1.0
Total Bond Stereocenter Count 0.0
Esol -3.5929755565217403
Inchi InChI=1S/C18H20O5/c1-22-16-6-2-11-3-7-17(23-18(11)14(16)8-9-19)13-5-4-12(20)10-15(13)21/h2,4-6,10,17,19-21H,3,7-9H2,1H3/t17-/m1/s1
Smiles COC1=C(C2=C(CC[C@@H](O2)C3=C(C=C(C=C3)O)O)C=C1)CCO
Nring 4.0
Defined Bond Stereocenter Count 0.0

  • 1. Outgoing r'ship FOUND_IN to/from Acacia Acuminata (Plant) Rel Props:Reference:
  • 2. Outgoing r'ship FOUND_IN to/from Acacia Adunca (Plant) Rel Props:Reference:
  • 3. Outgoing r'ship FOUND_IN to/from Acacia Arabica (Plant) Rel Props:Reference:
  • 4. Outgoing r'ship FOUND_IN to/from Acacia Armata (Plant) Rel Props:Reference:
  • 5. Outgoing r'ship FOUND_IN to/from Acacia Aroma (Plant) Rel Props:Reference:
  • 6. Outgoing r'ship FOUND_IN to/from Acacia Aulacocarpa (Plant) Rel Props:Reference:
  • 7. Outgoing r'ship FOUND_IN to/from Acacia Auriculaeformis (Plant) Rel Props:Reference:
  • 8. Outgoing r'ship FOUND_IN to/from Acacia Auriculiformis (Plant) Rel Props:Reference:
  • 9. Outgoing r'ship FOUND_IN to/from Acacia Caesia (Plant) Rel Props:Reference:
  • 10. Outgoing r'ship FOUND_IN to/from Acacia Cambagei (Plant) Rel Props:Reference:
  • 11. Outgoing r'ship FOUND_IN to/from Acacia Catechu (Plant) Rel Props:Reference:
  • 12. Outgoing r'ship FOUND_IN to/from Acacia Caven (Plant) Rel Props:Reference:
  • 13. Outgoing r'ship FOUND_IN to/from Acacia Chundra (Plant) Rel Props:Reference:
  • 14. Outgoing r'ship FOUND_IN to/from Acacia Concinna (Plant) Rel Props:Reference:
  • 15. Outgoing r'ship FOUND_IN to/from Acacia Confusa (Plant) Rel Props:Reference:
  • 16. Outgoing r'ship FOUND_IN to/from Acacia Dealbata (Plant) Rel Props:Reference:
  • 17. Outgoing r'ship FOUND_IN to/from Acacia Decurrens (Plant) Rel Props:Reference:
  • 18. Outgoing r'ship FOUND_IN to/from Acacia Farnesiana (Plant) Rel Props:Reference:
  • 19. Outgoing r'ship FOUND_IN to/from Acacia Ferruginea (Plant) Rel Props:Reference:
  • 20. Outgoing r'ship FOUND_IN to/from Acacia Glaucescens (Plant) Rel Props:Reference:
  • 21. Outgoing r'ship FOUND_IN to/from Acacia Indica (Plant) Rel Props:Reference:
  • 22. Outgoing r'ship FOUND_IN to/from Acacia Jacquemontii (Plant) Rel Props:Reference:
  • 23. Outgoing r'ship FOUND_IN to/from Acacia Kempeana (Plant) Rel Props:Reference:
  • 24. Outgoing r'ship FOUND_IN to/from Acacia Lasiopetala (Plant) Rel Props:Reference:
  • 25. Outgoing r'ship FOUND_IN to/from Acacia Lemmoni (Plant) Rel Props:Reference:
  • 26. Outgoing r'ship FOUND_IN to/from Acacia Lenticularis (Plant) Rel Props:Reference:
  • 27. Outgoing r'ship FOUND_IN to/from Acacia Leucophloea (Plant) Rel Props:Reference:
  • 28. Outgoing r'ship FOUND_IN to/from Acacia Linarioides (Plant) Rel Props:Reference:
  • 29. Outgoing r'ship FOUND_IN to/from Acacia Mearnsii (Plant) Rel Props:Reference:
  • 30. Outgoing r'ship FOUND_IN to/from Acacia Melanoxylon (Plant) Rel Props:Reference:
  • 31. Outgoing r'ship FOUND_IN to/from Acacia Modesta (Plant) Rel Props:Reference:
  • 32. Outgoing r'ship FOUND_IN to/from Acacia Mollissima (Plant) Rel Props:Reference:
  • 33. Outgoing r'ship FOUND_IN to/from Acacia Nilotica (Plant) Rel Props:Reference:
  • 34. Outgoing r'ship FOUND_IN to/from Acacia Pachyphloia (Plant) Rel Props:Reference:
  • 35. Outgoing r'ship FOUND_IN to/from Acacia Pennata (Plant) Rel Props:Reference:
  • 36. Outgoing r'ship FOUND_IN to/from Acacia Planifrons (Plant) Rel Props:Reference:
  • 37. Outgoing r'ship FOUND_IN to/from Acacia Polyacantha (Plant) Rel Props:Reference:
  • 38. Outgoing r'ship FOUND_IN to/from Acacia Pruinosa (Plant) Rel Props:Reference:
  • 39. Outgoing r'ship FOUND_IN to/from Acacia Pubescens (Plant) Rel Props:Reference:
  • 40. Outgoing r'ship FOUND_IN to/from Acacia Pulchella (Plant) Rel Props:Reference:
  • 41. Outgoing r'ship FOUND_IN to/from Acacia Pycnantha (Plant) Rel Props:Reference:
  • 42. Outgoing r'ship FOUND_IN to/from Acacia Salicina (Plant) Rel Props:Reference:
  • 43. Outgoing r'ship FOUND_IN to/from Acacia Saligna (Plant) Rel Props:Reference:
  • 44. Outgoing r'ship FOUND_IN to/from Acacia Schweinfurthii (Plant) Rel Props:Reference:
  • 45. Outgoing r'ship FOUND_IN to/from Acacia Senegal (Plant) Rel Props:Reference:
  • 46. Outgoing r'ship FOUND_IN to/from Acacia Seyal (Plant) Rel Props:Reference:
  • 47. Outgoing r'ship FOUND_IN to/from Acacia Simplicifolia (Plant) Rel Props:Reference:
  • 48. Outgoing r'ship FOUND_IN to/from Acacia Sinuata (Plant) Rel Props:Reference:
  • 49. Outgoing r'ship FOUND_IN to/from Acacia Sparsiflora (Plant) Rel Props:Reference:
  • 50. Outgoing r'ship FOUND_IN to/from Acacia Spirorbis (Plant) Rel Props:Reference:
  • 51. Outgoing r'ship FOUND_IN to/from Acacia Tomentosa (Plant) Rel Props:Reference:
  • 52. Outgoing r'ship FOUND_IN to/from Acacia Torta (Plant) Rel Props:Reference:
  • 53. Outgoing r'ship FOUND_IN to/from Acacia Tortilis (Plant) Rel Props:Reference:
  • 54. Outgoing r'ship FOUND_IN to/from Acacia Victoria (Plant) Rel Props:Reference:
  • 55. Outgoing r'ship FOUND_IN to/from Agastache Rugosa (Plant) Rel Props:Reference:
  • 56. Outgoing r'ship FOUND_IN to/from Ageratina Adenophora (Plant) Rel Props:Reference:
  • 57. Outgoing r'ship FOUND_IN to/from Ageratina Dendroides (Plant) Rel Props:Reference:
  • 58. Outgoing r'ship FOUND_IN to/from Ageratina Ligustrina (Plant) Rel Props:Reference:
  • 59. Outgoing r'ship FOUND_IN to/from Ageratina Riparia (Plant) Rel Props:Reference:
  • 60. Outgoing r'ship FOUND_IN to/from Ageratina Saltillensis (Plant) Rel Props:Reference:
  • 61. Outgoing r'ship FOUND_IN to/from Ageratina Tomentella (Plant) Rel Props:Reference:
  • 62. Outgoing r'ship FOUND_IN to/from Alstonia Yunnanensis (Plant) Rel Props:Reference:
  • 63. Outgoing r'ship FOUND_IN to/from Amentotaxus Yunnanensis (Plant) Rel Props:Reference:
  • 64. Outgoing r'ship FOUND_IN to/from Begonia Socotrana (Plant) Rel Props:Reference:
  • 65. Outgoing r'ship FOUND_IN to/from Combretum Yunnanensis (Plant) Rel Props:Reference:
  • 66. Outgoing r'ship FOUND_IN to/from Crateva Adansonii (Plant) Rel Props:Reference:
  • 67. Outgoing r'ship FOUND_IN to/from Crateva Nurvala (Plant) Rel Props:Reference:
  • 68. Outgoing r'ship FOUND_IN to/from Crateva Religiosa (Plant) Rel Props:Source_db:npass_chem_all; Reference:
  • 69. Outgoing r'ship FOUND_IN to/from Ficus Religiosa (Plant) Rel Props:Reference:
  • 70. Outgoing r'ship FOUND_IN to/from Gaultheria Yunnanensis (Plant) Rel Props:Reference:
  • 71. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Yunnanensis (Plant) Rel Props:Reference:
  • 72. Outgoing r'ship FOUND_IN to/from Heracleum Aquilegifolium (Plant) Rel Props:Reference:
  • 73. Outgoing r'ship FOUND_IN to/from Heracleum Candicans (Plant) Rel Props:Reference:
  • 74. Outgoing r'ship FOUND_IN to/from Heracleum Candolleanum (Plant) Rel Props:Reference:
  • 75. Outgoing r'ship FOUND_IN to/from Heracleum Canescens (Plant) Rel Props:Reference:
  • 76. Outgoing r'ship FOUND_IN to/from Heracleum Granatense (Plant) Rel Props:Reference:
  • 77. Outgoing r'ship FOUND_IN to/from Heracleum Lanatum (Plant) Rel Props:Reference:
  • 78. Outgoing r'ship FOUND_IN to/from Heracleum Mantegazzianum (Plant) Rel Props:Reference:
  • 79. Outgoing r'ship FOUND_IN to/from Heracleum Maximum (Plant) Rel Props:Reference:
  • 80. Outgoing r'ship FOUND_IN to/from Heracleum Moellendorffii (Plant) Rel Props:Reference:
  • 81. Outgoing r'ship FOUND_IN to/from Heracleum Nepalense (Plant) Rel Props:Reference:
  • 82. Outgoing r'ship FOUND_IN to/from Heracleum Pinda (Plant) Rel Props:Reference:
  • 83. Outgoing r'ship FOUND_IN to/from Heracleum Pinnatum (Plant) Rel Props:Reference:
  • 84. Outgoing r'ship FOUND_IN to/from Heracleum Rapula (Plant) Rel Props:Reference:
  • 85. Outgoing r'ship FOUND_IN to/from Heracleum Rigens (Plant) Rel Props:Reference:
  • 86. Outgoing r'ship FOUND_IN to/from Heracleum Scabridum (Plant) Rel Props:Reference:
  • 87. Outgoing r'ship FOUND_IN to/from Heracleum Sphondylium (Plant) Rel Props:Reference:
  • 88. Outgoing r'ship FOUND_IN to/from Heracleum Sprengelianum (Plant) Rel Props:Reference:
  • 89. Outgoing r'ship FOUND_IN to/from Heracleum Thomsonii (Plant) Rel Props:Reference:
  • 90. Outgoing r'ship FOUND_IN to/from Heracleum Wallichii (Plant) Rel Props:Reference:
  • 91. Outgoing r'ship FOUND_IN to/from Heracleum Yungningense (Plant) Rel Props:Reference:
  • 92. Outgoing r'ship FOUND_IN to/from Hesperocyparis Arizonica (Plant) Rel Props:Reference:
  • 93. Outgoing r'ship FOUND_IN to/from Hesperocyparis Goveniana (Plant) Rel Props:Reference:
  • 94. Outgoing r'ship FOUND_IN to/from Hesperocyparis Macrocarpa (Plant) Rel Props:Reference:
  • 95. Outgoing r'ship FOUND_IN to/from Hesperocyparis Nevadensis (Plant) Rel Props:Reference:
  • 96. Outgoing r'ship FOUND_IN to/from Limnophila Rugosa (Plant) Rel Props:Reference:
  • 97. Outgoing r'ship FOUND_IN to/from Michelia Yunnanensis (Plant) Rel Props:Reference:
  • 98. Outgoing r'ship FOUND_IN to/from Morus Alba (Plant) Rel Props:Reference:
  • 99. Outgoing r'ship FOUND_IN to/from Morus Australis (Plant) Rel Props:Reference:
  • 100. Outgoing r'ship FOUND_IN to/from Morus Bombycis (Plant) Rel Props:Reference:
  • 101. Outgoing r'ship FOUND_IN to/from Morus Cathayana (Plant) Rel Props:Reference:
  • 102. Outgoing r'ship FOUND_IN to/from Morus Indica (Plant) Rel Props:Reference:
  • 103. Outgoing r'ship FOUND_IN to/from Morus Macroma (Plant) Rel Props:Reference:
  • 104. Outgoing r'ship FOUND_IN to/from Morus Macroura (Plant) Rel Props:Reference:
  • 105. Outgoing r'ship FOUND_IN to/from Morus Mongolica (Plant) Rel Props:Reference:
  • 106. Outgoing r'ship FOUND_IN to/from Morus Nigra (Plant) Rel Props:Reference:
  • 107. Outgoing r'ship FOUND_IN to/from Morus Rubra (Plant) Rel Props:Reference:
  • 108. Outgoing r'ship FOUND_IN to/from Morus Serrata (Plant) Rel Props:Reference:
  • 109. Outgoing r'ship FOUND_IN to/from Morus Yunnanensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 110. Outgoing r'ship FOUND_IN to/from Oenothera Rosa (Plant) Rel Props:Reference:
  • 111. Outgoing r'ship FOUND_IN to/from Ophiorrhiza Rugosa (Plant) Rel Props:Reference:
  • 112. Outgoing r'ship FOUND_IN to/from Phlegmariurus Yunnanensis (Plant) Rel Props:Reference:
  • 113. Outgoing r'ship FOUND_IN to/from Pholidota Yunnanensis (Plant) Rel Props:Reference:
  • 114. Outgoing r'ship FOUND_IN to/from Pinus Yunnanensis (Plant) Rel Props:Reference:
  • 115. Outgoing r'ship FOUND_IN to/from Pleione Yunnanensis (Plant) Rel Props:Reference:
  • 116. Outgoing r'ship FOUND_IN to/from Populus Yunnanensis (Plant) Rel Props:Reference:
  • 117. Outgoing r'ship FOUND_IN to/from Pterocephalus Hookeri (Plant) Rel Props:Reference:
  • 118. Outgoing r'ship FOUND_IN to/from Rabdosia Rugosa (Plant) Rel Props:Reference:
  • 119. Outgoing r'ship FOUND_IN to/from Rauvolfia Yunnanensis (Plant) Rel Props:Reference:
  • 120. Outgoing r'ship FOUND_IN to/from Rosa Agrestis (Plant) Rel Props:Reference:
  • 121. Outgoing r'ship FOUND_IN to/from Rosa Alba (Plant) Rel Props:Reference:
  • 122. Outgoing r'ship FOUND_IN to/from Rosa Banksiae (Plant) Rel Props:Reference:
  • 123. Outgoing r'ship FOUND_IN to/from Rosa Brunonii (Plant) Rel Props:Reference:
  • 124. Outgoing r'ship FOUND_IN to/from Rosa Canina (Plant) Rel Props:Reference:
  • 125. Outgoing r'ship FOUND_IN to/from Rosa Centifolia (Plant) Rel Props:Reference:
  • 126. Outgoing r'ship FOUND_IN to/from Rosa Chinensis (Plant) Rel Props:Reference:
  • 127. Outgoing r'ship FOUND_IN to/from Rosa Cymosa (Plant) Rel Props:Reference:
  • 128. Outgoing r'ship FOUND_IN to/from Rosa Damascena (Plant) Rel Props:Reference:
  • 129. Outgoing r'ship FOUND_IN to/from Rosa Davidii (Plant) Rel Props:Reference:
  • 130. Outgoing r'ship FOUND_IN to/from Rosa Davurica (Plant) Rel Props:Reference:
  • 131. Outgoing r'ship FOUND_IN to/from Rosa Eglanteria (Plant) Rel Props:Reference:
  • 132. Outgoing r'ship FOUND_IN to/from Rosa Foetida (Plant) Rel Props:Reference:
  • 133. Outgoing r'ship FOUND_IN to/from Rosa Gallica (Plant) Rel Props:Reference:
  • 134. Outgoing r'ship FOUND_IN to/from Rosa Henryi (Plant) Rel Props:Reference:
  • 135. Outgoing r'ship FOUND_IN to/from Rosa Hybrid (Plant) Rel Props:Reference:
  • 136. Outgoing r'ship FOUND_IN to/from Rosa Indica (Plant) Rel Props:Reference:
  • 137. Outgoing r'ship FOUND_IN to/from Rosa Laevigata (Plant) Rel Props:Reference:
  • 138. Outgoing r'ship FOUND_IN to/from Rosa Macrophylla (Plant) Rel Props:Reference:
  • 139. Outgoing r'ship FOUND_IN to/from Rosa Moschata (Plant) Rel Props:Reference:
  • 140. Outgoing r'ship FOUND_IN to/from Rosa Multiflora (Plant) Rel Props:Reference:
  • 141. Outgoing r'ship FOUND_IN to/from Rosa Pomifera (Plant) Rel Props:Reference:
  • 142. Outgoing r'ship FOUND_IN to/from Rosa Roxburghii (Plant) Rel Props:Reference:
  • 143. Outgoing r'ship FOUND_IN to/from Rosa Rubra (Plant) Rel Props:Reference:
  • 144. Outgoing r'ship FOUND_IN to/from Rosa Rugosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 145. Outgoing r'ship FOUND_IN to/from Rosa Sericea (Plant) Rel Props:Reference:
  • 146. Outgoing r'ship FOUND_IN to/from Rosa Sinesis (Plant) Rel Props:Reference:
  • 147. Outgoing r'ship FOUND_IN to/from Rosa Transmorrisonensis (Plant) Rel Props:Reference:
  • 148. Outgoing r'ship FOUND_IN to/from Rosa Webbiana (Plant) Rel Props:Reference:
  • 149. Outgoing r'ship FOUND_IN to/from Rosa Woodsii (Plant) Rel Props:Reference:
  • 150. Outgoing r'ship FOUND_IN to/from Rubia Yunnanensis (Plant) Rel Props:Reference:
  • 151. Outgoing r'ship FOUND_IN to/from Rubus Rosa (Plant) Rel Props:Reference:
  • 152. Outgoing r'ship FOUND_IN to/from Salvia Yunnanensis (Plant) Rel Props:Reference:
  • 153. Outgoing r'ship FOUND_IN to/from Sinodielsia Yunnanensis (Plant) Rel Props:Reference:
  • 154. Outgoing r'ship FOUND_IN to/from Torreya Fargesii (Plant) Rel Props:Reference:
  • 155. Outgoing r'ship FOUND_IN to/from Torreya Yunnanensis (Plant) Rel Props:Reference:
  • 156. Outgoing r'ship FOUND_IN to/from Vitis Rugosa (Plant) Rel Props:Reference:
  • 157. Outgoing r'ship FOUND_IN to/from Walsura Yunnanensis (Plant) Rel Props:Reference:
  • 158. Outgoing r'ship FOUND_IN to/from Ziziphus Rugosa (Plant) Rel Props:Reference:
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