This website is for informational and educational purposes only. Please do not self-medicate; contact a medical professional for advice before administration. This website is for informational and educational purposes only. Please do not self-medicate; contact a medical professional for advice before administration.

(1S,2R,4aS,6aS,6bR,10R,11R,12aR,14bS)-10,11-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid

PubChem CID: 5316084

Connections displayed (default: 10).
Loading graph...

ℹ️ Click here to know more about the properties
Compound Synonyms NCGC00384631-01
Prediction Swissadme 0.0
Topological Polar Surface Area 77.8
Hydrogen Bond Donor Count 3.0
Inchi Key HFGSQOYIOKBQOW-WZSFHCERSA-N
Fcsp3 0.9
Rotatable Bond Count 1.0
Heavy Atom Count 34.0
Compound Name (1S,2R,4aS,6aS,6bR,10R,11R,12aR,14bS)-10,11-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
Prediction Hob Swissadme 0.0
Exact Mass 472.355
Formal Charge 0.0
Monoisotopic Mass 472.355
Isotope Atom Count 0.0
Molecular Complexity 907.0
Hydrogen Bond Acceptor Count 4.0
Molecular Weight 472.7
Database Name cmaup_ingredients;npass_chem_all;pubchem
Covalent Unit Count 1.0
Defined Atom Stereocenter Count 9.0
Iupac Name (1S,2R,4aS,6aS,6bR,10R,11R,12aR,14bS)-10,11-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
Total Atom Stereocenter Count 11.0
Total Bond Stereocenter Count 0.0
Prediction Hob 1.0
Esol -6.717902000000001
Inchi InChI=1S/C30H48O4/c1-17-10-13-30(25(33)34)15-14-28(6)19(23(30)18(17)2)8-9-22-27(5)16-20(31)24(32)26(3,4)21(27)11-12-29(22,28)7/h8,17-18,20-24,31-32H,9-16H2,1-7H3,(H,33,34)/t17-,18+,20-,21?,22?,23+,24+,27+,28-,29-,30+/m1/s1
Smiles C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CCC4[C@]3(CCC5[C@@]4(C[C@H]([C@@H](C5(C)C)O)O)C)C)[C@@H]2[C@H]1C)C)C(=O)O
Xlogp 6.4
Defined Bond Stereocenter Count 0.0
Molecular Formula C30H48O4

  • 1. Outgoing r'ship FOUND_IN to/from Heynea Trijuga (Plant) Rel Props:Reference:
  • 2. Outgoing r'ship FOUND_IN to/from Rubus Adenotrichos (Plant) Rel Props:Reference:
  • 3. Outgoing r'ship FOUND_IN to/from Rubus Alceifolius (Plant) Rel Props:Reference:
  • 4. Outgoing r'ship FOUND_IN to/from Rubus Barberi (Plant) Rel Props:Reference:
  • 5. Outgoing r'ship FOUND_IN to/from Rubus Biflorus (Plant) Rel Props:Reference:
  • 6. Outgoing r'ship FOUND_IN to/from Rubus Chingii (Plant) Rel Props:Reference:
  • 7. Outgoing r'ship FOUND_IN to/from Rubus Chroosepalus (Plant) Rel Props:Reference:
  • 8. Outgoing r'ship FOUND_IN to/from Rubus Coreanus (Plant) Rel Props:Reference:
  • 9. Outgoing r'ship FOUND_IN to/from Rubus Ellipticus (Plant) Rel Props:Reference:
  • 10. Outgoing r'ship FOUND_IN to/from Rubus Foliolatus (Plant) Rel Props:Reference:
  • 11. Outgoing r'ship FOUND_IN to/from Rubus Foliolosus (Plant) Rel Props:Reference:
  • 12. Outgoing r'ship FOUND_IN to/from Rubus Fruticosus (Plant) Rel Props:Reference:
  • 13. Outgoing r'ship FOUND_IN to/from Rubus Glaucus (Plant) Rel Props:Reference:
  • 14. Outgoing r'ship FOUND_IN to/from Rubus Hirsutus (Plant) Rel Props:Reference:
  • 15. Outgoing r'ship FOUND_IN to/from Rubus Hoffmeisterianus (Plant) Rel Props:Reference:
  • 16. Outgoing r'ship FOUND_IN to/from Rubus Idaeus (Plant) Rel Props:Reference:
  • 17. Outgoing r'ship FOUND_IN to/from Rubus Koehneanus (Plant) Rel Props:Reference:
  • 18. Outgoing r'ship FOUND_IN to/from Rubus Laciniatus (Plant) Rel Props:Reference:
  • 19. Outgoing r'ship FOUND_IN to/from Rubus Lambertianus (Plant) Rel Props:Reference:
  • 20. Outgoing r'ship FOUND_IN to/from Rubus Moluccanus (Plant) Rel Props:Reference:
  • 21. Outgoing r'ship FOUND_IN to/from Rubus Nepalensis (Plant) Rel Props:Reference:
  • 22. Outgoing r'ship FOUND_IN to/from Rubus Niveus (Plant) Rel Props:Reference:
  • 23. Outgoing r'ship FOUND_IN to/from Rubus Occidentalis (Plant) Rel Props:Reference:
  • 24. Outgoing r'ship FOUND_IN to/from Rubus Parkeri (Plant) Rel Props:Reference:
  • 25. Outgoing r'ship FOUND_IN to/from Rubus Parviforlius (Plant) Rel Props:Reference:
  • 26. Outgoing r'ship FOUND_IN to/from Rubus Pedunculosus (Plant) Rel Props:Reference:
  • 27. Outgoing r'ship FOUND_IN to/from Rubus Phoenicolasius (Plant) Rel Props:Reference:
  • 28. Outgoing r'ship FOUND_IN to/from Rubus Pileatus (Plant) Rel Props:Reference:
  • 29. Outgoing r'ship FOUND_IN to/from Rubus Plicatus (Plant) Rel Props:Reference:
  • 30. Outgoing r'ship FOUND_IN to/from Rubus Pungens (Plant) Rel Props:Reference:
  • 31. Outgoing r'ship FOUND_IN to/from Rubus Rigidus (Plant) Rel Props:Reference:
  • 32. Outgoing r'ship FOUND_IN to/from Rubus Rosa (Plant) Rel Props:Reference:
  • 33. Outgoing r'ship FOUND_IN to/from Rubus Rugosus (Plant) Rel Props:Reference:
  • 34. Outgoing r'ship FOUND_IN to/from Rubus Sanctus (Plant) Rel Props:Reference:
  • 35. Outgoing r'ship FOUND_IN to/from Rubus Trifidus (Plant) Rel Props:Reference:
  • 36. Outgoing r'ship FOUND_IN to/from Rubus Ulmifolius (Plant) Rel Props:Reference:
  • 37. Outgoing r'ship FOUND_IN to/from Rubus Xanthocarpus (Plant) Rel Props:Reference:
  • 38. Outgoing r'ship FOUND_IN to/from Salvia Aegyptiaca (Plant) Rel Props:Reference:
  • 39. Outgoing r'ship FOUND_IN to/from Salvia Bowleyana (Plant) Rel Props:Reference:
  • 40. Outgoing r'ship FOUND_IN to/from Salvia Broussonetii (Plant) Rel Props:Reference:
  • 41. Outgoing r'ship FOUND_IN to/from Salvia Bulleyana (Plant) Rel Props:Reference:
  • 42. Outgoing r'ship FOUND_IN to/from Salvia Cana (Plant) Rel Props:Reference:
  • 43. Outgoing r'ship FOUND_IN to/from Salvia Canariensis (Plant) Rel Props:Reference:
  • 44. Outgoing r'ship FOUND_IN to/from Salvia Carduacea (Plant) Rel Props:Reference:
  • 45. Outgoing r'ship FOUND_IN to/from Salvia Castanea (Plant) Rel Props:Reference:
  • 46. Outgoing r'ship FOUND_IN to/from Salvia Cilicica (Plant) Rel Props:Reference:
  • 47. Outgoing r'ship FOUND_IN to/from Salvia Clevelandii (Plant) Rel Props:Reference:
  • 48. Outgoing r'ship FOUND_IN to/from Salvia Coccinea (Plant) Rel Props:Reference:
  • 49. Outgoing r'ship FOUND_IN to/from Salvia Coulteri (Plant) Rel Props:Reference:
  • 50. Outgoing r'ship FOUND_IN to/from Salvia Cyanescens (Plant) Rel Props:Reference:
  • 51. Outgoing r'ship FOUND_IN to/from Salvia Dichroa (Plant) Rel Props:Reference:
  • 52. Outgoing r'ship FOUND_IN to/from Salvia Digitaloides (Plant) Rel Props:Reference:
  • 53. Outgoing r'ship FOUND_IN to/from Salvia Divaricata (Plant) Rel Props:Reference:
  • 54. Outgoing r'ship FOUND_IN to/from Salvia Dorrii (Plant) Rel Props:Reference:
  • 55. Outgoing r'ship FOUND_IN to/from Salvia Flava (Plant) Rel Props:Reference:
  • 56. Outgoing r'ship FOUND_IN to/from Salvia Glutinosa (Plant) Rel Props:Reference:
  • 57. Outgoing r'ship FOUND_IN to/from Salvia Greggii (Plant) Rel Props:Reference:
  • 58. Outgoing r'ship FOUND_IN to/from Salvia Hians (Plant) Rel Props:Reference:
  • 59. Outgoing r'ship FOUND_IN to/from Salvia Hispanica (Plant) Rel Props:Reference:
  • 60. Outgoing r'ship FOUND_IN to/from Salvia Horminum (Plant) Rel Props:Reference:
  • 61. Outgoing r'ship FOUND_IN to/from Salvia Hydrangea (Plant) Rel Props:Reference:
  • 62. Outgoing r'ship FOUND_IN to/from Salvia Karabachensis (Plant) Rel Props:Reference:
  • 63. Outgoing r'ship FOUND_IN to/from Salvia Lanigera (Plant) Rel Props:Reference:
  • 64. Outgoing r'ship FOUND_IN to/from Salvia Lasiantha (Plant) Rel Props:Reference:
  • 65. Outgoing r'ship FOUND_IN to/from Salvia Lavandulifolia (Plant) Rel Props:Reference:
  • 66. Outgoing r'ship FOUND_IN to/from Salvia Lavanduloides (Plant) Rel Props:Reference:
  • 67. Outgoing r'ship FOUND_IN to/from Salvia Leucantha (Plant) Rel Props:Reference:
  • 68. Outgoing r'ship FOUND_IN to/from Salvia Lineata (Plant) Rel Props:Reference:
  • 69. Outgoing r'ship FOUND_IN to/from Salvia Mellifera (Plant) Rel Props:Reference:
  • 70. Outgoing r'ship FOUND_IN to/from Salvia Microstegia (Plant) Rel Props:Reference:
  • 71. Outgoing r'ship FOUND_IN to/from Salvia Miltiorrhiza (Plant) Rel Props:Reference:
  • 72. Outgoing r'ship FOUND_IN to/from Salvia Miniata (Plant) Rel Props:Reference:
  • 73. Outgoing r'ship FOUND_IN to/from Salvia Mirzayanii (Plant) Rel Props:Reference:
  • 74. Outgoing r'ship FOUND_IN to/from Salvia Moorcroftiana (Plant) Rel Props:Reference:
  • 75. Outgoing r'ship FOUND_IN to/from Salvia Mukerjeei (Plant) Rel Props:Reference:
  • 76. Outgoing r'ship FOUND_IN to/from Salvia Munzii (Plant) Rel Props:Reference:
  • 77. Outgoing r'ship FOUND_IN to/from Salvia Nemorosa (Plant) Rel Props:Reference:
  • 78. Outgoing r'ship FOUND_IN to/from Salvia Nubicola (Plant) Rel Props:Reference:
  • 79. Outgoing r'ship FOUND_IN to/from Salvia Officinalis (Plant) Rel Props:Reference:
  • 80. Outgoing r'ship FOUND_IN to/from Salvia Oxyodon (Plant) Rel Props:Reference:
  • 81. Outgoing r'ship FOUND_IN to/from Salvia Pachyphylla (Plant) Rel Props:Reference:
  • 82. Outgoing r'ship FOUND_IN to/from Salvia Palaestina (Plant) Rel Props:Reference:
  • 83. Outgoing r'ship FOUND_IN to/from Salvia Parryi (Plant) Rel Props:Reference:
  • 84. Outgoing r'ship FOUND_IN to/from Salvia Patens (Plant) Rel Props:Reference:
  • 85. Outgoing r'ship FOUND_IN to/from Salvia Pisidica (Plant) Rel Props:Reference:
  • 86. Outgoing r'ship FOUND_IN to/from Salvia Plebeia (Plant) Rel Props:Reference:
  • 87. Outgoing r'ship FOUND_IN to/from Salvia Polystachya (Plant) Rel Props:Reference:
  • 88. Outgoing r'ship FOUND_IN to/from Salvia Pratensis (Plant) Rel Props:Reference:
  • 89. Outgoing r'ship FOUND_IN to/from Salvia Prionitis (Plant) Rel Props:Reference:
  • 90. Outgoing r'ship FOUND_IN to/from Salvia Przewalskii (Plant) Rel Props:Reference:
  • 91. Outgoing r'ship FOUND_IN to/from Salvia Przewalskll (Plant) Rel Props:Reference:
  • 92. Outgoing r'ship FOUND_IN to/from Salvia Roborowskii (Plant) Rel Props:Reference:
  • 93. Outgoing r'ship FOUND_IN to/from Salvia Sclarea (Plant) Rel Props:Reference:
  • 94. Outgoing r'ship FOUND_IN to/from Salvia Sessei (Plant) Rel Props:Reference:
  • 95. Outgoing r'ship FOUND_IN to/from Salvia Sinica (Plant) Rel Props:Reference:
  • 96. Outgoing r'ship FOUND_IN to/from Salvia Spinosa (Plant) Rel Props:Reference:
  • 97. Outgoing r'ship FOUND_IN to/from Salvia Splendens (Plant) Rel Props:Reference:
  • 98. Outgoing r'ship FOUND_IN to/from Salvia Spp (Plant) Rel Props:Reference:
  • 99. Outgoing r'ship FOUND_IN to/from Salvia Staminea (Plant) Rel Props:Reference:
  • 100. Outgoing r'ship FOUND_IN to/from Salvia Syriaca (Plant) Rel Props:Reference:
  • 101. Outgoing r'ship FOUND_IN to/from Salvia Tomentosa (Plant) Rel Props:Reference:
  • 102. Outgoing r'ship FOUND_IN to/from Salvia Trijuga (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 103. Outgoing r'ship FOUND_IN to/from Salvia Urolepis (Plant) Rel Props:Reference:
  • 104. Outgoing r'ship FOUND_IN to/from Salvia Verbenaca (Plant) Rel Props:Reference:
  • 105. Outgoing r'ship FOUND_IN to/from Salvia Virgata (Plant) Rel Props:Reference:
  • 106. Outgoing r'ship FOUND_IN to/from Salvia Viridis (Plant) Rel Props:Reference:
  • 107. Outgoing r'ship FOUND_IN to/from Salvia Wiedemannii (Plant) Rel Props:Reference:
  • 108. Outgoing r'ship FOUND_IN to/from Salvia Xalapensis (Plant) Rel Props:Reference:
  • 109. Outgoing r'ship FOUND_IN to/from Salvia Yosgadensis (Plant) Rel Props:Reference:
  • 110. Outgoing r'ship FOUND_IN to/from Salvia Yunnanensis (Plant) Rel Props:Reference:
  • 111. Outgoing r'ship FOUND_IN to/from Schleichera Trijuga (Plant) Rel Props:Reference:
Back to Browse   Back to Home