Khusitone
PubChem CID: 97046659
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | Khusitone, DTXSID801347172, 2221-76-3, Q63396412 |
|---|---|
| Topological Polar Surface Area | 17.1 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 15.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 324.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 3.0 |
| Iupac Name | 1-[(1S,4aS,8aS)-7-methyl-4-methylidene-2,3,4a,5,6,8a-hexahydro-1H-naphthalen-1-yl]ethanone |
| Prediction Hob | 1.0 |
| Xlogp | 2.2 |
| Molecular Formula | C14H20O |
| Prediction Swissadme | 0.0 |
| Inchi Key | YXIJNEOZFSAIAQ-MCIONIFRSA-N |
| Fcsp3 | 0.6428571428571429 |
| Logs | -3.078 |
| Rotatable Bond Count | 1.0 |
| Logd | 3.096 |
| Compound Name | Khusitone |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 204.151 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 204.151 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 204.31 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 3.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.4456406 |
| Inchi | InChI=1S/C14H20O/c1-9-4-6-12-10(2)5-7-13(11(3)15)14(12)8-9/h8,12-14H,2,4-7H2,1,3H3/t12-,13-,14+/m1/s1 |
| Smiles | CC1=C[C@H]2[C@H](CC1)C(=C)CC[C@@H]2C(=O)C |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Abies Alba (Plant) Rel Props:Reference: - 2. Outgoing r'ship
FOUND_INto/from Acacia Farnesiana (Plant) Rel Props:Reference: - 3. Outgoing r'ship
FOUND_INto/from Allium Ampeloprasum (Plant) Rel Props:Reference: - 4. Outgoing r'ship
FOUND_INto/from Allium Angulosum (Plant) Rel Props:Reference: - 5. Outgoing r'ship
FOUND_INto/from Allium Ascalonicum (Plant) Rel Props:Reference: - 6. Outgoing r'ship
FOUND_INto/from Allium Azureum (Plant) Rel Props:Reference: - 7. Outgoing r'ship
FOUND_INto/from Allium Carolinianum (Plant) Rel Props:Reference: - 8. Outgoing r'ship
FOUND_INto/from Allium Cepa (Plant) Rel Props:Reference: - 9. Outgoing r'ship
FOUND_INto/from Allium Chinense (Plant) Rel Props:Reference: - 10. Outgoing r'ship
FOUND_INto/from Allium Consanguineum (Plant) Rel Props:Reference: - 11. Outgoing r'ship
FOUND_INto/from Allium Fistulosum (Plant) Rel Props:Reference: - 12. Outgoing r'ship
FOUND_INto/from Allium Hookeri (Plant) Rel Props:Reference: - 13. Outgoing r'ship
FOUND_INto/from Allium Humile (Plant) Rel Props:Reference: - 14. Outgoing r'ship
FOUND_INto/from Allium Macleanii (Plant) Rel Props:Reference: - 15. Outgoing r'ship
FOUND_INto/from Allium Macrostemon (Plant) Rel Props:Reference: - 16. Outgoing r'ship
FOUND_INto/from Allium Monspessulanum (Plant) Rel Props:Reference: - 17. Outgoing r'ship
FOUND_INto/from Allium Neapolitanum (Plant) Rel Props:Reference: - 18. Outgoing r'ship
FOUND_INto/from Allium Nutans (Plant) Rel Props:Reference: - 19. Outgoing r'ship
FOUND_INto/from Allium Przewalskianum (Plant) Rel Props:Reference: - 20. Outgoing r'ship
FOUND_INto/from Allium Rhabdotum (Plant) Rel Props:Reference: - 21. Outgoing r'ship
FOUND_INto/from Allium Rosenorum (Plant) Rel Props:Reference: - 22. Outgoing r'ship
FOUND_INto/from Allium Sativum (Plant) Rel Props:Reference: - 23. Outgoing r'ship
FOUND_INto/from Allium Schoenoprasum (Plant) Rel Props:Reference: - 24. Outgoing r'ship
FOUND_INto/from Allium Stipitatum (Plant) Rel Props:Reference: - 25. Outgoing r'ship
FOUND_INto/from Allium Stracheyi (Plant) Rel Props:Reference: - 26. Outgoing r'ship
FOUND_INto/from Allium Tuberosum (Plant) Rel Props:Reference: - 27. Outgoing r'ship
FOUND_INto/from Allium Ursinum (Plant) Rel Props:Reference: - 28. Outgoing r'ship
FOUND_INto/from Allium Victorialis (Plant) Rel Props:Reference: - 29. Outgoing r'ship
FOUND_INto/from Allium Wallichii (Plant) Rel Props:Reference: - 30. Outgoing r'ship
FOUND_INto/from Aloe Littoralis (Plant) Rel Props:Reference: - 31. Outgoing r'ship
FOUND_INto/from Araucaria Angustifolia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 32. Outgoing r'ship
FOUND_INto/from Aristolochia Littoralis (Plant) Rel Props:Reference: - 33. Outgoing r'ship
FOUND_INto/from Avicennia Alba (Plant) Rel Props:Reference: - 34. Outgoing r'ship
FOUND_INto/from Basella Alba (Plant) Rel Props:Reference: - 35. Outgoing r'ship
FOUND_INto/from Brassica Alba (Plant) Rel Props:Reference: - 36. Outgoing r'ship
FOUND_INto/from Bryonia Alba (Plant) Rel Props:Reference: - 37. Outgoing r'ship
FOUND_INto/from Caltha Alba (Plant) Rel Props:Reference: - 38. Outgoing r'ship
FOUND_INto/from Canella Alba (Plant) Rel Props:Reference: - 39. Outgoing r'ship
FOUND_INto/from Cepa Alba (Plant) Rel Props:Reference: - 40. Outgoing r'ship
FOUND_INto/from Chiococca Alba (Plant) Rel Props:Reference: - 41. Outgoing r'ship
FOUND_INto/from Citharexylum Spinosum (Plant) Rel Props:Reference: - 42. Outgoing r'ship
FOUND_INto/from Cryptocarya Alba (Plant) Rel Props:Reference: - 43. Outgoing r'ship
FOUND_INto/from Cussonia Bancoensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 44. Outgoing r'ship
FOUND_INto/from Cynoglossum Amabile (Plant) Rel Props:Reference: - 45. Outgoing r'ship
FOUND_INto/from Cynoglossum Formosanum (Plant) Rel Props:Reference: - 46. Outgoing r'ship
FOUND_INto/from Cynoglossum Germanicum (Plant) Rel Props:Reference: - 47. Outgoing r'ship
FOUND_INto/from Cynoglossum Lanceolatum (Plant) Rel Props:Reference: - 48. Outgoing r'ship
FOUND_INto/from Cynoglossum Macrostylum (Plant) Rel Props:Reference: - 49. Outgoing r'ship
FOUND_INto/from Cynoglossum Officinale (Plant) Rel Props:Reference: - 50. Outgoing r'ship
FOUND_INto/from Cynoglossum Pictum (Plant) Rel Props:Reference: - 51. Outgoing r'ship
FOUND_INto/from Cynoglossum Viridiflorum (Plant) Rel Props:Reference: - 52. Outgoing r'ship
FOUND_INto/from Cynoglossum Wallichii (Plant) Rel Props:Reference: - 53. Outgoing r'ship
FOUND_INto/from Cynoglossum Zeylanicum (Plant) Rel Props:Reference: - 54. Outgoing r'ship
FOUND_INto/from Datura Alba (Plant) Rel Props:Reference: - 55. Outgoing r'ship
FOUND_INto/from Drypetes Littoralis (Plant) Rel Props:Reference: - 56. Outgoing r'ship
FOUND_INto/from Eclipta Alba (Plant) Rel Props:Reference: - 57. Outgoing r'ship
FOUND_INto/from Eria Alba (Plant) Rel Props:Reference: - 58. Outgoing r'ship
FOUND_INto/from Eucalyptus Alba (Plant) Rel Props:Reference: - 59. Outgoing r'ship
FOUND_INto/from Glehnia Littoralis (Plant) Rel Props:Reference: - 60. Outgoing r'ship
FOUND_INto/from Griselinia Littoralis (Plant) Rel Props:Reference: - 61. Outgoing r'ship
FOUND_INto/from Heritiera Littoralis (Plant) Rel Props:Reference: - 62. Outgoing r'ship
FOUND_INto/from Hymenocallis Littoralis (Plant) Rel Props:Reference: - 63. Outgoing r'ship
FOUND_INto/from Ipomea Alba (Plant) Rel Props:Reference: - 64. Outgoing r'ship
FOUND_INto/from Ipomoea Alba (Plant) Rel Props:Reference: - 65. Outgoing r'ship
FOUND_INto/from Lawsonia Alba (Plant) Rel Props:Reference: - 66. Outgoing r'ship
FOUND_INto/from Lippia Adoensis (Plant) Rel Props:Reference: - 67. Outgoing r'ship
FOUND_INto/from Lippia Alba (Plant) Rel Props:Source_db:npass_chem_all - 68. Outgoing r'ship
FOUND_INto/from Lippia Brachypoda (Plant) Rel Props:Reference: - 69. Outgoing r'ship
FOUND_INto/from Lippia Carviodora (Plant) Rel Props:Reference: - 70. Outgoing r'ship
FOUND_INto/from Lippia Citriodora (Plant) Rel Props:Reference: - 71. Outgoing r'ship
FOUND_INto/from Lippia Dulcis (Plant) Rel Props:Reference: - 72. Outgoing r'ship
FOUND_INto/from Lippia Javanica (Plant) Rel Props:Reference: - 73. Outgoing r'ship
FOUND_INto/from Lippia Mexicana (Plant) Rel Props:Reference: - 74. Outgoing r'ship
FOUND_INto/from Lippia Nodiflora (Plant) Rel Props:Reference: - 75. Outgoing r'ship
FOUND_INto/from Lippia Sidoides (Plant) Rel Props:Reference: - 76. Outgoing r'ship
FOUND_INto/from Lysimachia Candida (Plant) Rel Props:Reference: - 77. Outgoing r'ship
FOUND_INto/from Lysimachia Christinae (Plant) Rel Props:Reference: - 78. Outgoing r'ship
FOUND_INto/from Lysimachia Clethroides (Plant) Rel Props:Reference: - 79. Outgoing r'ship
FOUND_INto/from Lysimachia Congestiflora (Plant) Rel Props:Reference: - 80. Outgoing r'ship
FOUND_INto/from Lysimachia Fordiana (Plant) Rel Props:Reference: - 81. Outgoing r'ship
FOUND_INto/from Lysimachia Mauritiana (Plant) Rel Props:Reference: - 82. Outgoing r'ship
FOUND_INto/from Lysimachia Microcarpa (Plant) Rel Props:Reference: - 83. Outgoing r'ship
FOUND_INto/from Lysimachia Paridiformis (Plant) Rel Props:Reference: - 84. Outgoing r'ship
FOUND_INto/from Manilkara Littoralis (Plant) Rel Props:Reference: - 85. Outgoing r'ship
FOUND_INto/from Melilotus Alba (Plant) Rel Props:Reference: - 86. Outgoing r'ship
FOUND_INto/from Michelia Alba (Plant) Rel Props:Reference: - 87. Outgoing r'ship
FOUND_INto/from Morus Alba (Plant) Rel Props:Reference: - 88. Outgoing r'ship
FOUND_INto/from Nicotiana Acuminata (Plant) Rel Props:Reference: - 89. Outgoing r'ship
FOUND_INto/from Nicotiana Affinis (Plant) Rel Props:Reference: - 90. Outgoing r'ship
FOUND_INto/from Nicotiana Debneyi (Plant) Rel Props:Reference: - 91. Outgoing r'ship
FOUND_INto/from Nicotiana Gossei (Plant) Rel Props:Reference: - 92. Outgoing r'ship
FOUND_INto/from Nicotiana Macrophylla (Plant) Rel Props:Reference: - 93. Outgoing r'ship
FOUND_INto/from Nicotiana Plumbaginifolia (Plant) Rel Props:Reference: - 94. Outgoing r'ship
FOUND_INto/from Nicotiana Raimondii (Plant) Rel Props:Reference: - 95. Outgoing r'ship
FOUND_INto/from Nicotiana Rustica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 96. Outgoing r'ship
FOUND_INto/from Nicotiana Sylvestris (Plant) Rel Props:Reference: - 97. Outgoing r'ship
FOUND_INto/from Nicotiana Tabacum (Plant) Rel Props:Reference: - 98. Outgoing r'ship
FOUND_INto/from Nicotiana Undulata (Plant) Rel Props:Reference: - 99. Outgoing r'ship
FOUND_INto/from Nymphaea Alba (Plant) Rel Props:Reference: - 100. Outgoing r'ship
FOUND_INto/from Plecospermum Spinosum (Plant) Rel Props:Reference: - 101. Outgoing r'ship
FOUND_INto/from Plumeria Alba (Plant) Rel Props:Reference: - 102. Outgoing r'ship
FOUND_INto/from Populus Alba (Plant) Rel Props:Reference: - 103. Outgoing r'ship
FOUND_INto/from Potentilla Alba (Plant) Rel Props:Reference: - 104. Outgoing r'ship
FOUND_INto/from Rosa Alba (Plant) Rel Props:Reference: - 105. Outgoing r'ship
FOUND_INto/from Salix Alba (Plant) Rel Props:Reference: - 106. Outgoing r'ship
FOUND_INto/from Sida Alba (Plant) Rel Props:Reference: - 107. Outgoing r'ship
FOUND_INto/from Sideroxylon Spinosum (Plant) Rel Props:Reference: - 108. Outgoing r'ship
FOUND_INto/from Sinapis Alba (Plant) Rel Props:Reference: - 109. Outgoing r'ship
FOUND_INto/from Sonneratia Alba (Plant) Rel Props:Reference: - 110. Outgoing r'ship
FOUND_INto/from Teucrium Alyssifolium (Plant) Rel Props:Reference: - 111. Outgoing r'ship
FOUND_INto/from Teucrium Asiaticum (Plant) Rel Props:Reference: - 112. Outgoing r'ship
FOUND_INto/from Teucrium Betonicum (Plant) Rel Props:Reference: - 113. Outgoing r'ship
FOUND_INto/from Teucrium Bidentatum (Plant) Rel Props:Reference: - 114. Outgoing r'ship
FOUND_INto/from Teucrium Chamaedrys (Plant) Rel Props:Reference: - 115. Outgoing r'ship
FOUND_INto/from Teucrium Cossonii (Plant) Rel Props:Reference: - 116. Outgoing r'ship
FOUND_INto/from Teucrium Depressum (Plant) Rel Props:Reference: - 117. Outgoing r'ship
FOUND_INto/from Teucrium Fragile (Plant) Rel Props:Reference: - 118. Outgoing r'ship
FOUND_INto/from Teucrium Fruticans (Plant) Rel Props:Reference: - 119. Outgoing r'ship
FOUND_INto/from Teucrium Heterophyllum (Plant) Rel Props:Reference: - 120. Outgoing r'ship
FOUND_INto/from Teucrium Lanigerum (Plant) Rel Props:Reference: - 121. Outgoing r'ship
FOUND_INto/from Teucrium Leucocladum (Plant) Rel Props:Reference: - 122. Outgoing r'ship
FOUND_INto/from Teucrium Marum (Plant) Rel Props:Reference: - 123. Outgoing r'ship
FOUND_INto/from Teucrium Montanum (Plant) Rel Props:Reference: - 124. Outgoing r'ship
FOUND_INto/from Teucrium Nuchense (Plant) Rel Props:Reference: - 125. Outgoing r'ship
FOUND_INto/from Teucrium Orientale (Plant) Rel Props:Reference: - 126. Outgoing r'ship
FOUND_INto/from Teucrium Oxylepis (Plant) Rel Props:Reference: - 127. Outgoing r'ship
FOUND_INto/from Teucrium Pernyi (Plant) Rel Props:Reference: - 128. Outgoing r'ship
FOUND_INto/from Teucrium Pestalozzae (Plant) Rel Props:Reference: - 129. Outgoing r'ship
FOUND_INto/from Teucrium Pilosum (Plant) Rel Props:Reference: - 130. Outgoing r'ship
FOUND_INto/from Teucrium Polium (Plant) Rel Props:Reference: - 131. Outgoing r'ship
FOUND_INto/from Teucrium Quadrifarium (Plant) Rel Props:Reference: - 132. Outgoing r'ship
FOUND_INto/from Teucrium Scordium (Plant) Rel Props:Reference: - 133. Outgoing r'ship
FOUND_INto/from Teucrium Scorodonia (Plant) Rel Props:Reference: - 134. Outgoing r'ship
FOUND_INto/from Teucrium Viscidum (Plant) Rel Props:Reference: - 135. Outgoing r'ship
FOUND_INto/from Teucrium Yemense (Plant) Rel Props:Reference: - 136. Outgoing r'ship
FOUND_INto/from Vachellia Karroo (Plant) Rel Props:Reference: - 137. Outgoing r'ship
FOUND_INto/from Vachellia Leucophloea (Plant) Rel Props:Reference: - 138. Outgoing r'ship
FOUND_INto/from Vachellia Nilotica (Plant) Rel Props:Reference: - 139. Outgoing r'ship
FOUND_INto/from Vachellia Pennatula (Plant) Rel Props:Reference: - 140. Outgoing r'ship
FOUND_INto/from Verbascum Spinosum (Plant) Rel Props:Reference: - 141. Outgoing r'ship
FOUND_INto/from Verbena Littoralis (Plant) Rel Props:Reference: - 142. Outgoing r'ship
FOUND_INto/from Xanthium Spinosum (Plant) Rel Props:Reference: - 143. Outgoing r'ship
FOUND_INto/from Zanthoxylum Spinosum (Plant) Rel Props:Reference: