Lobocompactol A
PubChem CID: 54583411
Connections displayed (default: 10).
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| Compound Synonyms | Lobocompactol A, (1R,5E,9S)-9-((2R)-2-(2-hydroxypropan-2-yl)-3,6-dihydro-2H-pyran-5-yl)-6-methyl-2-methylidenecyclodec-5-en-1-ol, (1R,5E,9S)-9-[(2R)-2-(2-hydroxypropan-2-yl)-3,6-dihydro-2H-pyran-5-yl]-6-methyl-2-methylidenecyclodec-5-en-1-ol, CHEMBL1762125 |
|---|---|
| Topological Polar Surface Area | 49.7 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 23.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 487.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 3.0 |
| Uniprot Id | n.a. |
| Iupac Name | (1R,5E,9S)-9-[(2R)-2-(2-hydroxypropan-2-yl)-3,6-dihydro-2H-pyran-5-yl]-6-methyl-2-methylidenecyclodec-5-en-1-ol |
| Prediction Hob | 1.0 |
| Xlogp | 2.2 |
| Molecular Formula | C20H32O3 |
| Prediction Swissadme | 1.0 |
| Inchi Key | UQFRWBRHRWRNEJ-BVSRWBKESA-N |
| Fcsp3 | 0.7 |
| Logs | -3.756 |
| Rotatable Bond Count | 2.0 |
| Logd | 3.297 |
| Compound Name | Lobocompactol A |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 320.235 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 320.235 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 320.5 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 3.0 |
| Total Bond Stereocenter Count | 1.0 |
| Esol | -3.0935326 |
| Inchi | InChI=1S/C20H32O3/c1-14-6-5-7-15(2)18(21)12-16(9-8-14)17-10-11-19(23-13-17)20(3,4)22/h6,10,16,18-19,21-22H,2,5,7-9,11-13H2,1,3-4H3/b14-6+/t16-,18+,19+/m0/s1 |
| Smiles | C/C/1=C\CCC(=C)[C@@H](C[C@H](CC1)C2=CC[C@@H](OC2)C(C)(C)O)O |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 1.0 |
- 1. Outgoing r'ship
FOUND_INto/from Actaea Racemosa (Plant) Rel Props:Reference: - 2. Outgoing r'ship
FOUND_INto/from Adina Racemosa (Plant) Rel Props:Reference: - 3. Outgoing r'ship
FOUND_INto/from Aesculus Carnea (Plant) Rel Props:Reference: - 4. Outgoing r'ship
FOUND_INto/from Aralia Racemosa (Plant) Rel Props:Reference: - 5. Outgoing r'ship
FOUND_INto/from Asplenium Laciniatum (Plant) Rel Props:Reference: - 6. Outgoing r'ship
FOUND_INto/from Atalantia Racemosa (Plant) Rel Props:Reference: - 7. Outgoing r'ship
FOUND_INto/from Atuna Racemosa (Plant) Rel Props:Reference: - 8. Outgoing r'ship
FOUND_INto/from Barringtonia Racemosa (Plant) Rel Props:Reference: - 9. Outgoing r'ship
FOUND_INto/from Bauhima Racemosa (Plant) Rel Props:Reference: - 10. Outgoing r'ship
FOUND_INto/from Bauhinia Racemosa (Plant) Rel Props:Reference: - 11. Outgoing r'ship
FOUND_INto/from Caulerpa Racemosa (Plant) Rel Props:Reference: - 12. Outgoing r'ship
FOUND_INto/from Choisya Arizonica (Plant) Rel Props:Reference: - 13. Outgoing r'ship
FOUND_INto/from Cimicifuga Racemosa (Plant) Rel Props:Reference: - 14. Outgoing r'ship
FOUND_INto/from Citrus Acida (Plant) Rel Props:Reference: - 15. Outgoing r'ship
FOUND_INto/from Citrus Aurantifolia (Plant) Rel Props:Reference: - 16. Outgoing r'ship
FOUND_INto/from Citrus Aurantiifolia (Plant) Rel Props:Reference: - 17. Outgoing r'ship
FOUND_INto/from Citrus Aurantium (Plant) Rel Props:Reference: - 18. Outgoing r'ship
FOUND_INto/from Citrus Bergamia (Plant) Rel Props:Reference: - 19. Outgoing r'ship
FOUND_INto/from Citrus Chachiensis (Plant) Rel Props:Reference: - 20. Outgoing r'ship
FOUND_INto/from Citrus Decumana (Plant) Rel Props:Reference: - 21. Outgoing r'ship
FOUND_INto/from Citrus Erythrosa (Plant) Rel Props:Reference: - 22. Outgoing r'ship
FOUND_INto/from Citrus Funadoko (Plant) Rel Props:Reference: - 23. Outgoing r'ship
FOUND_INto/from Citrus Glauca (Plant) Rel Props:Reference: - 24. Outgoing r'ship
FOUND_INto/from Citrus Grandis (Plant) Rel Props:Reference: - 25. Outgoing r'ship
FOUND_INto/from Citrus Hassaku (Plant) Rel Props:Reference: - 26. Outgoing r'ship
FOUND_INto/from Citrus Hybr (Plant) Rel Props:Reference: - 27. Outgoing r'ship
FOUND_INto/from Citrus Hystrix (Plant) Rel Props:Reference: - 28. Outgoing r'ship
FOUND_INto/from Citrus Indica (Plant) Rel Props:Reference: - 29. Outgoing r'ship
FOUND_INto/from Citrus Jambhiri (Plant) Rel Props:Reference: - 30. Outgoing r'ship
FOUND_INto/from Citrus Japonica (Plant) Rel Props:Reference: - 31. Outgoing r'ship
FOUND_INto/from Citrus Junos (Plant) Rel Props:Reference: - 32. Outgoing r'ship
FOUND_INto/from Citrus Latifolia (Plant) Rel Props:Reference: - 33. Outgoing r'ship
FOUND_INto/from Citrus Latipes (Plant) Rel Props:Reference: - 34. Outgoing r'ship
FOUND_INto/from Citrus Limon (Plant) Rel Props:Reference: - 35. Outgoing r'ship
FOUND_INto/from Citrus Limonia (Plant) Rel Props:Reference: - 36. Outgoing r'ship
FOUND_INto/from Citrus Maxima (Plant) Rel Props:Reference: - 37. Outgoing r'ship
FOUND_INto/from Citrus Medica (Plant) Rel Props:Reference: - 38. Outgoing r'ship
FOUND_INto/from Citrus Mitis (Plant) Rel Props:Reference: - 39. Outgoing r'ship
FOUND_INto/from Citrus Natsudaidai (Plant) Rel Props:Reference: - 40. Outgoing r'ship
FOUND_INto/from Citrus Nobilis (Plant) Rel Props:Reference: - 41. Outgoing r'ship
FOUND_INto/from Citrus Paradisi (Plant) Rel Props:Reference: - 42. Outgoing r'ship
FOUND_INto/from Citrus Pennivesiculata (Plant) Rel Props:Reference: - 43. Outgoing r'ship
FOUND_INto/from Citrus Pseudolimon (Plant) Rel Props:Reference: - 44. Outgoing r'ship
FOUND_INto/from Citrus Reshni (Plant) Rel Props:Reference: - 45. Outgoing r'ship
FOUND_INto/from Citrus Reticulata (Plant) Rel Props:Reference: - 46. Outgoing r'ship
FOUND_INto/from Citrus Reticulate (Plant) Rel Props:Reference: - 47. Outgoing r'ship
FOUND_INto/from Citrus Rugulosa (Plant) Rel Props:Reference: - 48. Outgoing r'ship
FOUND_INto/from Citrus Sinensis (Plant) Rel Props:Reference: - 49. Outgoing r'ship
FOUND_INto/from Citrus Sudachii (Plant) Rel Props:Reference: - 50. Outgoing r'ship
FOUND_INto/from Citrus Tachibana (Plant) Rel Props:Reference: - 51. Outgoing r'ship
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FOUND_INto/from Citrus Tangemna (Plant) Rel Props:Reference: - 53. Outgoing r'ship
FOUND_INto/from Citrus Tangerina (Plant) Rel Props:Reference: - 54. Outgoing r'ship
FOUND_INto/from Citrus Tankan (Plant) Rel Props:Reference: - 55. Outgoing r'ship
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FOUND_INto/from Citrus Unshiu (Plant) Rel Props:Reference: - 57. Outgoing r'ship
FOUND_INto/from Citrus Wilsonii (Plant) Rel Props:Reference: - 58. Outgoing r'ship
FOUND_INto/from Citrus X (Plant) Rel Props:Reference: - 59. Outgoing r'ship
FOUND_INto/from Citrus Yuko (Plant) Rel Props:Reference: - 60. Outgoing r'ship
FOUND_INto/from Corydalis Racemosa (Plant) Rel Props:Reference: - 61. Outgoing r'ship
FOUND_INto/from Cosmostigma Racemosa (Plant) Rel Props:Reference: - 62. Outgoing r'ship
FOUND_INto/from Cussonia Racemosa (Plant) Rel Props:Reference: - 63. Outgoing r'ship
FOUND_INto/from Cyclea Racemosa (Plant) Rel Props:Reference: - 64. Outgoing r'ship
FOUND_INto/from Danae Racemosa (Plant) Rel Props:Reference: - 65. Outgoing r'ship
FOUND_INto/from Daphnopsis Racemosa (Plant) Rel Props:Reference: - 66. Outgoing r'ship
FOUND_INto/from Endosamara Racemosa (Plant) Rel Props:Reference: - 67. Outgoing r'ship
FOUND_INto/from Eucalyptus Alata (Plant) Rel Props:Reference: - 68. Outgoing r'ship
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FOUND_INto/from Eucalyptus Amplifolia (Plant) Rel Props:Reference: - 71. Outgoing r'ship
FOUND_INto/from Eucalyptus Apodophylla (Plant) Rel Props:Reference: - 72. Outgoing r'ship
FOUND_INto/from Eucalyptus Astringens (Plant) Rel Props:Reference: - 73. Outgoing r'ship
FOUND_INto/from Eucalyptus Australiana (Plant) Rel Props:Reference: - 74. Outgoing r'ship
FOUND_INto/from Eucalyptus Baueriana (Plant) Rel Props:Reference: - 75. Outgoing r'ship
FOUND_INto/from Eucalyptus Berghei (Plant) Rel Props:Reference: - 76. Outgoing r'ship
FOUND_INto/from Eucalyptus Camaldulensis (Plant) Rel Props:Reference: - 77. Outgoing r'ship
FOUND_INto/from Eucalyptus Cameldulensis (Plant) Rel Props:Reference: - 78. Outgoing r'ship
FOUND_INto/from Eucalyptus Campanulata (Plant) Rel Props:Reference: - 79. Outgoing r'ship
FOUND_INto/from Eucalyptus Cinerea (Plant) Rel Props:Reference: - 80. Outgoing r'ship
FOUND_INto/from Eucalyptus Citriodora (Plant) Rel Props:Reference: - 81. Outgoing r'ship
FOUND_INto/from Eucalyptus Cladocalyx (Plant) Rel Props:Reference: - 82. Outgoing r'ship
FOUND_INto/from Eucalyptus Coccifera (Plant) Rel Props:Reference: - 83. Outgoing r'ship
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FOUND_INto/from Eucalyptus Deglupta (Plant) Rel Props:Reference: - 88. Outgoing r'ship
FOUND_INto/from Eucalyptus Delegatensis (Plant) Rel Props:Reference: - 89. Outgoing r'ship
FOUND_INto/from Eucalyptus Dives (Plant) Rel Props:Reference: - 90. Outgoing r'ship
FOUND_INto/from Eucalyptus Dundasii (Plant) Rel Props:Reference: - 91. Outgoing r'ship
FOUND_INto/from Eucalyptus Exserta (Plant) Rel Props:Reference: - 92. Outgoing r'ship
FOUND_INto/from Eucalyptus Flocktoniae (Plant) Rel Props:Reference: - 93. Outgoing r'ship
FOUND_INto/from Eucalyptus Foecunda (Plant) Rel Props:Reference: - 94. Outgoing r'ship
FOUND_INto/from Eucalyptus Froggattii (Plant) Rel Props:Reference: - 95. Outgoing r'ship
FOUND_INto/from Eucalyptus Globulus (Plant) Rel Props:Reference: - 96. Outgoing r'ship
FOUND_INto/from Eucalyptus Goniocalyx (Plant) Rel Props:Reference: - 97. Outgoing r'ship
FOUND_INto/from Eucalyptus Grandis (Plant) Rel Props:Reference: - 98. Outgoing r'ship
FOUND_INto/from Eucalyptus Gunnii (Plant) Rel Props:Reference: - 99. Outgoing r'ship
FOUND_INto/from Eucalyptus Haemastoma (Plant) Rel Props:Reference: - 100. Outgoing r'ship
FOUND_INto/from Eucalyptus Hybrid (Plant) Rel Props:Reference: - 101. Outgoing r'ship
FOUND_INto/from Eucalyptus Hybrida (Plant) Rel Props:Reference: - 102. Outgoing r'ship
FOUND_INto/from Eucalyptus Jenseni (Plant) Rel Props:Reference: - 103. Outgoing r'ship
FOUND_INto/from Eucalyptus Jensenii (Plant) Rel Props:Reference: - 104. Outgoing r'ship
FOUND_INto/from Eucalyptus Kirtoniana (Plant) Rel Props:Reference: - 105. Outgoing r'ship
FOUND_INto/from Eucalyptus Kitsoni (Plant) Rel Props:Reference: - 106. Outgoing r'ship
FOUND_INto/from Eucalyptus Kitsoniana (Plant) Rel Props:Reference: - 107. Outgoing r'ship
FOUND_INto/from Eucalyptus Lanceolatus (Plant) Rel Props:Reference: - 108. Outgoing r'ship
FOUND_INto/from Eucalyptus Leucoxylon (Plant) Rel Props:Reference: - 109. Outgoing r'ship
FOUND_INto/from Eucalyptus Luehmanniana (Plant) Rel Props:Reference: - 110. Outgoing r'ship
FOUND_INto/from Eucalyptus Macarthurii (Plant) Rel Props:Reference: - 111. Outgoing r'ship
FOUND_INto/from Eucalyptus Macrocarpa (Plant) Rel Props:Reference: - 112. Outgoing r'ship
FOUND_INto/from Eucalyptus Macrorhyncha (Plant) Rel Props:Reference: - 113. Outgoing r'ship
FOUND_INto/from Eucalyptus Maideni (Plant) Rel Props:Reference: - 114. Outgoing r'ship
FOUND_INto/from Eucalyptus Melanophloia (Plant) Rel Props:Reference: - 115. Outgoing r'ship
FOUND_INto/from Eucalyptus Melliodora (Plant) Rel Props:Reference: - 116. Outgoing r'ship
FOUND_INto/from Eucalyptus Michaeliana (Plant) Rel Props:Reference: - 117. Outgoing r'ship
FOUND_INto/from Eucalyptus Microcorys (Plant) Rel Props:Reference: - 118. Outgoing r'ship
FOUND_INto/from Eucalyptus Microtheca (Plant) Rel Props:Reference: - 119. Outgoing r'ship
FOUND_INto/from Eucalyptus Moluccana (Plant) Rel Props:Reference: - 120. Outgoing r'ship
FOUND_INto/from Eucalyptus Obliqua (Plant) Rel Props:Reference: - 121. Outgoing r'ship
FOUND_INto/from Eucalyptus Ovata (Plant) Rel Props:Reference: - 122. Outgoing r'ship
FOUND_INto/from Eucalyptus Perriniana (Plant) Rel Props:Reference: - 123. Outgoing r'ship
FOUND_INto/from Eucalyptus Phellandra (Plant) Rel Props:Reference: - 124. Outgoing r'ship
FOUND_INto/from Eucalyptus Platypus (Plant) Rel Props:Reference: - 125. Outgoing r'ship
FOUND_INto/from Eucalyptus Polyanthemos (Plant) Rel Props:Reference: - 126. Outgoing r'ship
FOUND_INto/from Eucalyptus Populnea (Plant) Rel Props:Reference: - 127. Outgoing r'ship
FOUND_INto/from Eucalyptus Pulverulenta (Plant) Rel Props:Reference: - 128. Outgoing r'ship
FOUND_INto/from Eucalyptus Radiata (Plant) Rel Props:Reference: - 129. Outgoing r'ship
FOUND_INto/from Eucalyptus Regnans (Plant) Rel Props:Reference: - 130. Outgoing r'ship
FOUND_INto/from Eucalyptus Resinifera (Plant) Rel Props:Reference: - 131. Outgoing r'ship
FOUND_INto/from Eucalyptus Risdonii (Plant) Rel Props:Reference: - 132. Outgoing r'ship
FOUND_INto/from Eucalyptus Robusta (Plant) Rel Props:Reference: - 133. Outgoing r'ship
FOUND_INto/from Eucalyptus Rubida (Plant) Rel Props:Reference: - 134. Outgoing r'ship
FOUND_INto/from Eucalyptus Rudis (Plant) Rel Props:Reference: - 135. Outgoing r'ship
FOUND_INto/from Eucalyptus Saligna (Plant) Rel Props:Reference: - 136. Outgoing r'ship
FOUND_INto/from Eucalyptus Sideroxylon (Plant) Rel Props:Reference: - 137. Outgoing r'ship
FOUND_INto/from Eucalyptus Sieberi (Plant) Rel Props:Reference: - 138. Outgoing r'ship
FOUND_INto/from Eucalyptus Sieberiana (Plant) Rel Props:Reference: - 139. Outgoing r'ship
FOUND_INto/from Eucalyptus Smithii (Plant) Rel Props:Reference: - 140. Outgoing r'ship
FOUND_INto/from Eucalyptus Staigeriana (Plant) Rel Props:Reference: - 141. Outgoing r'ship
FOUND_INto/from Eucalyptus Tereticornis (Plant) Rel Props:Reference: - 142. Outgoing r'ship
FOUND_INto/from Eucalyptus Urnigera (Plant) Rel Props:Reference: - 143. Outgoing r'ship
FOUND_INto/from Eucalyptus Urophylla (Plant) Rel Props:Reference: - 144. Outgoing r'ship
FOUND_INto/from Eucalyptus Viminalis (Plant) Rel Props:Reference: - 145. Outgoing r'ship
FOUND_INto/from Eucalyptus Viridis (Plant) Rel Props:Reference: - 146. Outgoing r'ship
FOUND_INto/from Eucalyptus Wandoo (Plant) Rel Props:Reference: - 147. Outgoing r'ship
FOUND_INto/from Eucalyptus Youmanii (Plant) Rel Props:Reference: - 148. Outgoing r'ship
FOUND_INto/from Euploca Racemosa (Plant) Rel Props:Reference: - 149. Outgoing r'ship
FOUND_INto/from Ficus Racemosa (Plant) Rel Props:Reference: - 150. Outgoing r'ship
FOUND_INto/from Gaillardia Aristata (Plant) Rel Props:Reference: - 151. Outgoing r'ship
FOUND_INto/from Gaillardia Coahuilensis (Plant) Rel Props:Reference: - 152. Outgoing r'ship
FOUND_INto/from Gaillardia Pulchella (Plant) Rel Props:Reference: - 153. Outgoing r'ship
FOUND_INto/from Gaillardia Tontalensis (Plant) Rel Props:Reference: - 154. Outgoing r'ship
FOUND_INto/from Helenium Amarum (Plant) Rel Props:Reference: - 155. Outgoing r'ship
FOUND_INto/from Helenium Arizonicum (Plant) Rel Props:Reference: - 156. Outgoing r'ship
FOUND_INto/from Helenium Aromaticum (Plant) Rel Props:Reference: - 157. Outgoing r'ship
FOUND_INto/from Helenium Autumnale (Plant) Rel Props:Reference: - 158. Outgoing r'ship
FOUND_INto/from Helenium Bigelovii (Plant) Rel Props:Reference: - 159. Outgoing r'ship
FOUND_INto/from Helenium Elegans (Plant) Rel Props:Reference: - 160. Outgoing r'ship
FOUND_INto/from Helenium Integrifolium (Plant) Rel Props:Reference: - 161. Outgoing r'ship
FOUND_INto/from Helenium Mexicanum (Plant) Rel Props:Reference: - 162. Outgoing r'ship
FOUND_INto/from Helenium Microcephalum (Plant) Rel Props:Reference: - 163. Outgoing r'ship
FOUND_INto/from Helenium Puberulum (Plant) Rel Props:Reference: - 164. Outgoing r'ship
FOUND_INto/from Helenium Quadridentatum (Plant) Rel Props:Reference: - 165. Outgoing r'ship
FOUND_INto/from Helenium Tenuifolium (Plant) Rel Props:Reference: - 166. Outgoing r'ship
FOUND_INto/from Helenium Virginicum (Plant) Rel Props:Reference: - 167. Outgoing r'ship
FOUND_INto/from Hesperocyparis Arizonica (Plant) Rel Props:Reference: - 168. Outgoing r'ship
FOUND_INto/from Inula Helenium (Plant) Rel Props:Reference: - 169. Outgoing r'ship
FOUND_INto/from Inula Racemosa (Plant) Rel Props:Reference: - 170. Outgoing r'ship
FOUND_INto/from Ipomoea Carnea (Plant) Rel Props:Reference: - 171. Outgoing r'ship
FOUND_INto/from Laguncularia Racemosa (Plant) Rel Props:Reference: - 172. Outgoing r'ship
FOUND_INto/from Limnophila Racemosa (Plant) Rel Props:Reference: - 173. Outgoing r'ship
FOUND_INto/from Lumnitzera Racemosa (Plant) Rel Props:Reference: - 174. Outgoing r'ship
FOUND_INto/from Mesua Beccariana (Plant) Rel Props:Reference: - 175. Outgoing r'ship
FOUND_INto/from Mesua Elegans (Plant) Rel Props:Reference: - 176. Outgoing r'ship
FOUND_INto/from Mesua Ferrea (Plant) Rel Props:Reference: - 177. Outgoing r'ship
FOUND_INto/from Mesua Racemosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 178. Outgoing r'ship
FOUND_INto/from Milletia Racemosa (Plant) Rel Props:Reference: - 179. Outgoing r'ship
FOUND_INto/from Millettia Racemosa (Plant) Rel Props:Reference: - 180. Outgoing r'ship
FOUND_INto/from Papaver Hybrid (Plant) Rel Props:Reference: - 181. Outgoing r'ship
FOUND_INto/from Pimenta Racemosa (Plant) Rel Props:Reference: - 182. Outgoing r'ship
FOUND_INto/from Reineckea Carnea (Plant) Rel Props:Reference: - 183. Outgoing r'ship
FOUND_INto/from Rosa Hybrid (Plant) Rel Props:Reference: - 184. Outgoing r'ship
FOUND_INto/from Sesamum Laciniatum (Plant) Rel Props:Reference: - 185. Outgoing r'ship
FOUND_INto/from Sinoadina Racemosa (Plant) Rel Props:Reference: - 186. Outgoing r'ship
FOUND_INto/from Solanum Laciniatum (Plant) Rel Props:Reference: - 187. Outgoing r'ship
FOUND_INto/from Symplocos Racemosa (Plant) Rel Props:Reference: - 188. Outgoing r'ship
FOUND_INto/from Tiliacora Racemosa (Plant) Rel Props:Reference: