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1,6,6-Trimethyl-1,2,6,7,8,9-hexahydrophenanthro[1,2-b]furan-10,11-dione

PubChem CID: 496348

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Compound Synonyms 17545-07-2, 1,6,6-Trimethyl-1,2,6,7,8,9-hexahydrophenanthro[1,2-b]furan-10,11-dione, Cryptanshinone, (-)-1,2,6,7,8,9,10,11-Octahydro-1,6,6-trimethylphenanthro[1,2-b]furan-10,11-dione, 1,6,6-trimethyl-1H,2H,6H,7H,8H,9H,10H,11H-phenanthro[1,2-b]furan-10,11-dione, 1,6,6-trimethyl-2,7,8,9-tetrahydro-1H-naphtho[1,2-g][1]benzofuran-10,11-dione, (-)-Cryptotanshinone, Cryptotanshinon, Tanshinone c, Cryototanshinone, NSC686518, 4733-35-1, UPCMLD-DP042, Neuro_000424, MLS006011840, SCHEMBL4126834, CHEMBL1518673, UPCMLD-DP042:001, GVKKJJOMQCNPGB-UHFFFAOYSA-, GVKKJJOMQCNPGB-UHFFFAOYSA-N, DTXSID001347166, HMS3655P20, BBL010026, STK801405, AKOS005612965, NCGC00095755-01, NCGC00095755-03, SMR004703500, SY068754, VS-02288, CS-0358058, NS00011871, AN-956/21205001, AO-088/21192003, EN300-18388658, 1,6,6-Trimethyl-1,2,6,7,8,9-hexahydrophenanthro[1,2-b]furan-10,11-dione-, (R)-, 1,6,6-trimethyl-2,7,8,9-tetrahydro-1H-naphtho[1,2-g]benzofuran-10,11-dione, 6,6,14-trimethyl-12-oxatetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1,7,9,11(15)-tetraene-16,17-dione, InChI=1/C19H20O3/c1-10-9-22-18-12-6-7-13-11(5-4-8-19(13,2)3)15(12)17(21)16(20)14(10)18/h6-7,10H,4-5,8-9H2,1-3H3
Topological Polar Surface Area 43.4
Hydrogen Bond Donor Count 0.0
Heavy Atom Count 22.0
Description Isolated from Rosmarinus officinalis (rosemary). Cryptotanshinone is found in herbs and spices.
Isotope Atom Count 0.0
Molecular Complexity 571.0
Database Name cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Uniprot Id Q03164, P46063, Q99714, B2RXH2, P55210, Q9NUW8, P10636, P25779, P00352, Q9F4F7, P02791, O97447, P15428, P54132, P08684, Q92830, Q96KQ7, O15296, P11473, Q9UBT6, O94782, P27695
Iupac Name 1,6,6-trimethyl-2,7,8,9-tetrahydro-1H-naphtho[1,2-g][1]benzofuran-10,11-dione
Prediction Hob 1.0
Class Prenol lipids
Target Id NPT47, NPT149, NPT48, NPT1226, NPT50, NPT51, NPT94, NPT151, NPT58, NPT109
Xlogp 3.8
Superclass Lipids and lipid-like molecules
Subclass Diterpenoids
Molecular Formula C19H20O3
Prediction Swissadme 0.0
Inchi Key GVKKJJOMQCNPGB-UHFFFAOYSA-N
Fcsp3 0.4736842105263157
Logs -3.916
Rotatable Bond Count 0.0
State Solid
Logd 3.87
Synonyms (-)-cryptotanshinone, Cryptotanshinone, (-)-Cryptotanshinone
Compound Name 1,6,6-Trimethyl-1,2,6,7,8,9-hexahydrophenanthro[1,2-b]furan-10,11-dione
Kingdom Organic compounds
Prediction Hob Swissadme 0.0
Exact Mass 296.141
Formal Charge 0.0
Monoisotopic Mass 296.141
Hydrogen Bond Acceptor Count 3.0
Molecular Weight 296.4
Covalent Unit Count 1.0
Total Atom Stereocenter Count 1.0
Total Bond Stereocenter Count 0.0
Molecular Framework Aromatic heteropolycyclic compounds
Esol -4.273287381818181
Inchi InChI=1S/C19H20O3/c1-10-9-22-18-12-6-7-13-11(5-4-8-19(13,2)3)15(12)17(21)16(20)14(10)18/h6-7,10H,4-5,8-9H2,1-3H3
Smiles CC1COC2=C1C(=O)C(=O)C3=C2C=CC4=C3CCCC4(C)C
Nring 4.0
Defined Bond Stereocenter Count 0.0
Taxonomy Direct Parent Tanshinones, isotanshinones, and derivatives

  • 1. Outgoing r'ship FOUND_IN to/from Alstonia Yunnanensis (Plant) Rel Props:Reference:
  • 2. Outgoing r'ship FOUND_IN to/from Amentotaxus Yunnanensis (Plant) Rel Props:Reference:
  • 3. Outgoing r'ship FOUND_IN to/from Barbacenia Flava (Plant) Rel Props:Reference:
  • 4. Outgoing r'ship FOUND_IN to/from Barlaria Prionitis (Plant) Rel Props:Reference:
  • 5. Outgoing r'ship FOUND_IN to/from Barleria Prionitis (Plant) Rel Props:Reference:
  • 6. Outgoing r'ship FOUND_IN to/from Blumeopsis Flava (Plant) Rel Props:Reference:
  • 7. Outgoing r'ship FOUND_IN to/from Bupleurum Sibiricum (Plant) Rel Props:Reference:
  • 8. Outgoing r'ship FOUND_IN to/from Buxus Microphylla (Plant) Rel Props:Reference:
  • 9. Outgoing r'ship FOUND_IN to/from Caragana Sinica (Plant) Rel Props:Reference:
  • 10. Outgoing r'ship FOUND_IN to/from Castanea Crenata (Plant) Rel Props:Reference:
  • 11. Outgoing r'ship FOUND_IN to/from Castanea Dentata (Plant) Rel Props:Reference:
  • 12. Outgoing r'ship FOUND_IN to/from Castanea Mollissima (Plant) Rel Props:Reference:
  • 13. Outgoing r'ship FOUND_IN to/from Castanea Sativa (Plant) Rel Props:Reference:
  • 14. Outgoing r'ship FOUND_IN to/from Castanea Vesca (Plant) Rel Props:Reference:
  • 15. Outgoing r'ship FOUND_IN to/from Combretum Yunnanensis (Plant) Rel Props:Reference:
  • 16. Outgoing r'ship FOUND_IN to/from Coriaria Sinica (Plant) Rel Props:Reference:
  • 17. Outgoing r'ship FOUND_IN to/from Ephedra Przewalskii (Plant) Rel Props:Reference:
  • 18. Outgoing r'ship FOUND_IN to/from Ephedra Sinica (Plant) Rel Props:Reference:
  • 19. Outgoing r'ship FOUND_IN to/from Fritillaria Przewalskii (Plant) Rel Props:Reference:
  • 20. Outgoing r'ship FOUND_IN to/from Gaultheria Yunnanensis (Plant) Rel Props:Reference:
  • 21. Outgoing r'ship FOUND_IN to/from Geranium Sibiricum (Plant) Rel Props:Reference:
  • 22. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Yunnanensis (Plant) Rel Props:Reference:
  • 23. Outgoing r'ship FOUND_IN to/from Heynea Trijuga (Plant) Rel Props:Reference:
  • 24. Outgoing r'ship FOUND_IN to/from Isodon Bulleyana (Plant) Rel Props:Reference:
  • 25. Outgoing r'ship FOUND_IN to/from Laggera Flava (Plant) Rel Props:Reference:
  • 26. Outgoing r'ship FOUND_IN to/from Ligularia Przewalskii (Plant) Rel Props:Reference:
  • 27. Outgoing r'ship FOUND_IN to/from Limnocharis Flava (Plant) Rel Props:Reference:
  • 28. Outgoing r'ship FOUND_IN to/from Michelia Yunnanensis (Plant) Rel Props:Reference:
  • 29. Outgoing r'ship FOUND_IN to/from Morus Yunnanensis (Plant) Rel Props:Reference:
  • 30. Outgoing r'ship FOUND_IN to/from Ormosia Flava (Plant) Rel Props:Reference:
  • 31. Outgoing r'ship FOUND_IN to/from Phlegmariurus Yunnanensis (Plant) Rel Props:Reference:
  • 32. Outgoing r'ship FOUND_IN to/from Pholidota Yunnanensis (Plant) Rel Props:Reference:
  • 33. Outgoing r'ship FOUND_IN to/from Pinus Yunnanensis (Plant) Rel Props:Reference:
  • 34. Outgoing r'ship FOUND_IN to/from Pleione Yunnanensis (Plant) Rel Props:Reference:
  • 35. Outgoing r'ship FOUND_IN to/from Polygonatum Sibiricum (Plant) Rel Props:Reference:
  • 36. Outgoing r'ship FOUND_IN to/from Populus Yunnanensis (Plant) Rel Props:Reference:
  • 37. Outgoing r'ship FOUND_IN to/from Radermachera Sinica (Plant) Rel Props:Reference:
  • 38. Outgoing r'ship FOUND_IN to/from Rauvolfia Yunnanensis (Plant) Rel Props:Reference:
  • 39. Outgoing r'ship FOUND_IN to/from Rhododendron Przewalskii (Plant) Rel Props:Reference:
  • 40. Outgoing r'ship FOUND_IN to/from Rubia Yunnanensis (Plant) Rel Props:Reference:
  • 41. Outgoing r'ship FOUND_IN to/from Salvia Aegyptiaca (Plant) Rel Props:Reference:
  • 42. Outgoing r'ship FOUND_IN to/from Salvia Bowleyana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 43. Outgoing r'ship FOUND_IN to/from Salvia Broussonetii (Plant) Rel Props:Reference:
  • 44. Outgoing r'ship FOUND_IN to/from Salvia Bulleyana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 45. Outgoing r'ship FOUND_IN to/from Salvia Cana (Plant) Rel Props:Reference:
  • 46. Outgoing r'ship FOUND_IN to/from Salvia Canariensis (Plant) Rel Props:Reference:
  • 47. Outgoing r'ship FOUND_IN to/from Salvia Carduacea (Plant) Rel Props:Reference:
  • 48. Outgoing r'ship FOUND_IN to/from Salvia Castanea (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 49. Outgoing r'ship FOUND_IN to/from Salvia Cilicica (Plant) Rel Props:Reference:
  • 50. Outgoing r'ship FOUND_IN to/from Salvia Clevelandii (Plant) Rel Props:Reference:
  • 51. Outgoing r'ship FOUND_IN to/from Salvia Coccinea (Plant) Rel Props:Reference:
  • 52. Outgoing r'ship FOUND_IN to/from Salvia Coulteri (Plant) Rel Props:Reference:
  • 53. Outgoing r'ship FOUND_IN to/from Salvia Cyanescens (Plant) Rel Props:Reference:
  • 54. Outgoing r'ship FOUND_IN to/from Salvia Dichroa (Plant) Rel Props:Reference:
  • 55. Outgoing r'ship FOUND_IN to/from Salvia Digitaloides (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 56. Outgoing r'ship FOUND_IN to/from Salvia Divaricata (Plant) Rel Props:Reference:
  • 57. Outgoing r'ship FOUND_IN to/from Salvia Dorrii (Plant) Rel Props:Reference:
  • 58. Outgoing r'ship FOUND_IN to/from Salvia Flava (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 59. Outgoing r'ship FOUND_IN to/from Salvia Glutinosa (Plant) Rel Props:Reference:
  • 60. Outgoing r'ship FOUND_IN to/from Salvia Greggii (Plant) Rel Props:Reference:
  • 61. Outgoing r'ship FOUND_IN to/from Salvia Hians (Plant) Rel Props:Reference:
  • 62. Outgoing r'ship FOUND_IN to/from Salvia Hispanica (Plant) Rel Props:Reference:
  • 63. Outgoing r'ship FOUND_IN to/from Salvia Horminum (Plant) Rel Props:Reference:
  • 64. Outgoing r'ship FOUND_IN to/from Salvia Hydrangea (Plant) Rel Props:Reference:
  • 65. Outgoing r'ship FOUND_IN to/from Salvia Karabachensis (Plant) Rel Props:Reference:
  • 66. Outgoing r'ship FOUND_IN to/from Salvia Lanigera (Plant) Rel Props:Reference:
  • 67. Outgoing r'ship FOUND_IN to/from Salvia Lasiantha (Plant) Rel Props:Reference:
  • 68. Outgoing r'ship FOUND_IN to/from Salvia Lavandulifolia (Plant) Rel Props:Reference:
  • 69. Outgoing r'ship FOUND_IN to/from Salvia Lavanduloides (Plant) Rel Props:Reference:
  • 70. Outgoing r'ship FOUND_IN to/from Salvia Leucantha (Plant) Rel Props:Reference:
  • 71. Outgoing r'ship FOUND_IN to/from Salvia Lineata (Plant) Rel Props:Reference:
  • 72. Outgoing r'ship FOUND_IN to/from Salvia Mellifera (Plant) Rel Props:Reference:
  • 73. Outgoing r'ship FOUND_IN to/from Salvia Microstegia (Plant) Rel Props:Reference:
  • 74. Outgoing r'ship FOUND_IN to/from Salvia Miltiorrhiza (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 75. Outgoing r'ship FOUND_IN to/from Salvia Miniata (Plant) Rel Props:Reference:
  • 76. Outgoing r'ship FOUND_IN to/from Salvia Mirzayanii (Plant) Rel Props:Reference:
  • 77. Outgoing r'ship FOUND_IN to/from Salvia Moorcroftiana (Plant) Rel Props:Reference:
  • 78. Outgoing r'ship FOUND_IN to/from Salvia Mukerjeei (Plant) Rel Props:Reference:
  • 79. Outgoing r'ship FOUND_IN to/from Salvia Munzii (Plant) Rel Props:Reference:
  • 80. Outgoing r'ship FOUND_IN to/from Salvia Nemorosa (Plant) Rel Props:Reference:
  • 81. Outgoing r'ship FOUND_IN to/from Salvia Nubicola (Plant) Rel Props:Reference:
  • 82. Outgoing r'ship FOUND_IN to/from Salvia Officinalis (Plant) Rel Props:Reference:
  • 83. Outgoing r'ship FOUND_IN to/from Salvia Oxyodon (Plant) Rel Props:Reference:
  • 84. Outgoing r'ship FOUND_IN to/from Salvia Pachyphylla (Plant) Rel Props:Reference:
  • 85. Outgoing r'ship FOUND_IN to/from Salvia Palaestina (Plant) Rel Props:Reference:
  • 86. Outgoing r'ship FOUND_IN to/from Salvia Parryi (Plant) Rel Props:Reference:
  • 87. Outgoing r'ship FOUND_IN to/from Salvia Patens (Plant) Rel Props:Reference:
  • 88. Outgoing r'ship FOUND_IN to/from Salvia Pisidica (Plant) Rel Props:Reference:
  • 89. Outgoing r'ship FOUND_IN to/from Salvia Plebeia (Plant) Rel Props:Reference:
  • 90. Outgoing r'ship FOUND_IN to/from Salvia Polystachya (Plant) Rel Props:Reference:
  • 91. Outgoing r'ship FOUND_IN to/from Salvia Pratensis (Plant) Rel Props:Reference:
  • 92. Outgoing r'ship FOUND_IN to/from Salvia Prionitis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 93. Outgoing r'ship FOUND_IN to/from Salvia Przewalskii (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 94. Outgoing r'ship FOUND_IN to/from Salvia Przewalskll (Plant) Rel Props:Source_db:npass_chem_all
  • 95. Outgoing r'ship FOUND_IN to/from Salvia Roborowskii (Plant) Rel Props:Reference:
  • 96. Outgoing r'ship FOUND_IN to/from Salvia Scalarea (Plant) Rel Props:Reference:
  • 97. Outgoing r'ship FOUND_IN to/from Salvia Sclarea (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 98. Outgoing r'ship FOUND_IN to/from Salvia Sessei (Plant) Rel Props:Reference:
  • 99. Outgoing r'ship FOUND_IN to/from Salvia Sinica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 100. Outgoing r'ship FOUND_IN to/from Salvia Spinosa (Plant) Rel Props:Reference:
  • 101. Outgoing r'ship FOUND_IN to/from Salvia Splendens (Plant) Rel Props:Reference:
  • 102. Outgoing r'ship FOUND_IN to/from Salvia Spp (Plant) Rel Props:Reference:
  • 103. Outgoing r'ship FOUND_IN to/from Salvia Staminea (Plant) Rel Props:Reference:
  • 104. Outgoing r'ship FOUND_IN to/from Salvia Syriaca (Plant) Rel Props:Reference:
  • 105. Outgoing r'ship FOUND_IN to/from Salvia Tomentosa (Plant) Rel Props:Reference:
  • 106. Outgoing r'ship FOUND_IN to/from Salvia Trijuga (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 107. Outgoing r'ship FOUND_IN to/from Salvia Urolepis (Plant) Rel Props:Reference:
  • 108. Outgoing r'ship FOUND_IN to/from Salvia Verbenaca (Plant) Rel Props:Reference:
  • 109. Outgoing r'ship FOUND_IN to/from Salvia Virgata (Plant) Rel Props:Reference:
  • 110. Outgoing r'ship FOUND_IN to/from Salvia Viridis (Plant) Rel Props:Reference:
  • 111. Outgoing r'ship FOUND_IN to/from Salvia Wiedemannii (Plant) Rel Props:Reference:
  • 112. Outgoing r'ship FOUND_IN to/from Salvia Xalapensis (Plant) Rel Props:Reference:
  • 113. Outgoing r'ship FOUND_IN to/from Salvia Yosgadensis (Plant) Rel Props:Reference:
  • 114. Outgoing r'ship FOUND_IN to/from Salvia Yunnanensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 115. Outgoing r'ship FOUND_IN to/from Sarracenia Flava (Plant) Rel Props:Reference:
  • 116. Outgoing r'ship FOUND_IN to/from Schleichera Trijuga (Plant) Rel Props:Reference:
  • 117. Outgoing r'ship FOUND_IN to/from Schlerichera Trijuga (Plant) Rel Props:Reference:
  • 118. Outgoing r'ship FOUND_IN to/from Scutellaria Przewalskii (Plant) Rel Props:Reference:
  • 119. Outgoing r'ship FOUND_IN to/from Seseli Sibiricum (Plant) Rel Props:Reference:
  • 120. Outgoing r'ship FOUND_IN to/from Sinodielsia Yunnanensis (Plant) Rel Props:Reference:
  • 121. Outgoing r'ship FOUND_IN to/from Stephania Sinica (Plant) Rel Props:Reference:
  • 122. Outgoing r'ship FOUND_IN to/from Tanacetum Sibiricum (Plant) Rel Props:Reference:
  • 123. Outgoing r'ship FOUND_IN to/from Torreya Fargesii (Plant) Rel Props:Reference:
  • 124. Outgoing r'ship FOUND_IN to/from Torreya Yunnanensis (Plant) Rel Props:Reference:
  • 125. Outgoing r'ship FOUND_IN to/from Tylophora Flava (Plant) Rel Props:Reference:
  • 126. Outgoing r'ship FOUND_IN to/from Veronicastrum Sibiricum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 127. Outgoing r'ship FOUND_IN to/from Veronicastrum Virginicum (Plant) Rel Props:Reference:
  • 128. Outgoing r'ship FOUND_IN to/from Walsura Yunnanensis (Plant) Rel Props:Reference:
  • 129. Outgoing r'ship FOUND_IN to/from Xanthium Sibiricum (Plant) Rel Props:Reference:
  • 130. Outgoing r'ship FOUND_IN to/from Zephyranthes Flava (Plant) Rel Props:Reference:
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