(4R,4aS,5R)-4-hydroxy-4a,5-dimethyl-5,6-dihydro-4H-naphthalene-1,7-dione

PubChem CID: 101316814

Connections displayed (default: 10).

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Topological Polar Surface Area	54.4
Hydrogen Bond Donor Count	1.0
Heavy Atom Count	15.0
Isotope Atom Count	0.0
Molecular Complexity	392.0
Database Name	cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count	3.0
Iupac Name	(4R,4aS,5R)-4-hydroxy-4a,5-dimethyl-5,6-dihydro-4H-naphthalene-1,7-dione
Prediction Hob	1.0
Xlogp	0.6
Molecular Formula	C12H14O3
Prediction Swissadme	0.0
Inchi Key	OJECHLISLNGTRS-HFKOZYHYSA-N
Fcsp3	0.5
Logs	-2.471
Rotatable Bond Count	0.0
Logd	-0.628
Compound Name	(4R,4aS,5R)-4-hydroxy-4a,5-dimethyl-5,6-dihydro-4H-naphthalene-1,7-dione
Prediction Hob Swissadme	0.0
Exact Mass	206.094
Formal Charge	0.0
Monoisotopic Mass	206.094
Hydrogen Bond Acceptor Count	3.0
Molecular Weight	206.24
Covalent Unit Count	1.0
Total Atom Stereocenter Count	3.0
Total Bond Stereocenter Count	0.0
Esol	-1.5092941999999998
Inchi	InChI=1S/C12H14O3/c1-7-5-8(13)6-9-10(14)3-4-11(15)12(7,9)2/h3-4,6-7,11,15H,5H2,1-2H3/t7-,11-,12+/m1/s1
Smiles	C[C@@H]1CC(=O)C=C2[C@]1([C@@H](C=CC2=O)O)C
Nring	2.0
Defined Bond Stereocenter Count	0.0

1. Outgoing r'ship FOUND_IN to/from Abelia Chinensis (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Actinidia Chinensis (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Aesculus Chinensis (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Albizia Chinensis (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Albizzia Chinensis (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Aloe Vera (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Alpinia Chinensis (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Anthocephalus Chinensis (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Aralia Chinensis (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Artemisia Chinensis (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Arundina Chinensis (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Astilbe Chinensis (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Atractylodes Chinensis (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Aucuba Chinensis (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Austrobaileya Scandens (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Bauhinia Scandens (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Belamcanda Chinensis (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Blumea Chinensis (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Boenninghausenia Albiflora (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Boerhavia Chinensis (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Breonia Chinensis (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Bridelia Scandens (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Celastrus Scandens (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Clematis Chinensis (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Cobaea Scandens (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Coptis Chinensis (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Cryptocarya Chinensis (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Cuscuta Chinensis (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Dactylicapnos Scandens (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Derris Scandens (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Desmos Chinensis (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Dianthus Chinensis (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Dicliptera Chinensis (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Embelia Ribes (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Entada Scandens (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Eremurus Chinensis (Plant) Rel Props:Reference:
37. Outgoing r'ship FOUND_IN to/from Erythropalum Scandens (Plant) Rel Props:Reference:
38. Outgoing r'ship FOUND_IN to/from Ficus Scandens (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Floscopa Scandens (Plant) Rel Props:Reference:
40. Outgoing r'ship FOUND_IN to/from Fraxinus Chinensis (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Gnetum Scandens (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Griselinia Scandens (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Hedyotis Scandens (Plant) Rel Props:Reference:
44. Outgoing r'ship FOUND_IN to/from Humulus Japonicus (Plant) Rel Props:Reference:
45. Outgoing r'ship FOUND_IN to/from Humulus Lupulus (Plant) Rel Props:Reference:
46. Outgoing r'ship FOUND_IN to/from Humulus Scandens (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
47. Outgoing r'ship FOUND_IN to/from Hydrangea Chinensis (Plant) Rel Props:Reference:
48. Outgoing r'ship FOUND_IN to/from Impatiens Chinensis (Plant) Rel Props:Reference:
49. Outgoing r'ship FOUND_IN to/from Inula Britannica (Plant) Rel Props:Reference:
50. Outgoing r'ship FOUND_IN to/from Iris Lactea (Plant) Rel Props:Reference:
51. Outgoing r'ship FOUND_IN to/from Ixeris Chinensis (Plant) Rel Props:Reference:
52. Outgoing r'ship FOUND_IN to/from Ixora Chinensis (Plant) Rel Props:Reference:
53. Outgoing r'ship FOUND_IN to/from Juniperus Chinensis (Plant) Rel Props:Reference:
54. Outgoing r'ship FOUND_IN to/from Klaseopsis Chinensis (Plant) Rel Props:Reference:
55. Outgoing r'ship FOUND_IN to/from Kopsia Albiflora (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
56. Outgoing r'ship FOUND_IN to/from Kopsia Flavida (Plant) Rel Props:Reference:
57. Outgoing r'ship FOUND_IN to/from Kopsia Fruticosa (Plant) Rel Props:Reference:
58. Outgoing r'ship FOUND_IN to/from Kopsia Grandifolia (Plant) Rel Props:Reference:
59. Outgoing r'ship FOUND_IN to/from Kopsia Hainanensis (Plant) Rel Props:Reference:
60. Outgoing r'ship FOUND_IN to/from Kopsia Lapidilecta (Plant) Rel Props:Reference:
61. Outgoing r'ship FOUND_IN to/from Kopsia Longiflora (Plant) Rel Props:Reference:
62. Outgoing r'ship FOUND_IN to/from Kopsia Officinalis (Plant) Rel Props:Reference:
63. Outgoing r'ship FOUND_IN to/from Kopsia Pauciflora (Plant) Rel Props:Reference:
64. Outgoing r'ship FOUND_IN to/from Kopsia Profunda (Plant) Rel Props:Reference:
65. Outgoing r'ship FOUND_IN to/from Kopsia Teoi (Plant) Rel Props:Reference:
66. Outgoing r'ship FOUND_IN to/from Listea Chinensis (Plant) Rel Props:Reference:
67. Outgoing r'ship FOUND_IN to/from Litchi Chinensis (Plant) Rel Props:Reference:
68. Outgoing r'ship FOUND_IN to/from Lobelia Chinensis (Plant) Rel Props:Reference:
69. Outgoing r'ship FOUND_IN to/from Luvunga Scandens (Plant) Rel Props:Reference:
70. Outgoing r'ship FOUND_IN to/from Lygodium Scandens (Plant) Rel Props:Reference:
71. Outgoing r'ship FOUND_IN to/from Matsumurella Chinensis (Plant) Rel Props:Reference:
72. Outgoing r'ship FOUND_IN to/from Mikania Scandens (Plant) Rel Props:Reference:
73. Outgoing r'ship FOUND_IN to/from Mosla Chinensis (Plant) Rel Props:Reference:
74. Outgoing r'ship FOUND_IN to/from Nardostachys Jatamansi (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
75. Outgoing r'ship FOUND_IN to/from Odontosoria Chinensis (Plant) Rel Props:Reference:
76. Outgoing r'ship FOUND_IN to/from Olax Scandens (Plant) Rel Props:Reference:
77. Outgoing r'ship FOUND_IN to/from Osbeckia Chinensis (Plant) Rel Props:Reference:
78. Outgoing r'ship FOUND_IN to/from Paederia Chinensis (Plant) Rel Props:Reference:
79. Outgoing r'ship FOUND_IN to/from Paederia Scandens (Plant) Rel Props:Reference:
80. Outgoing r'ship FOUND_IN to/from Persicaria Chinensis (Plant) Rel Props:Reference:
81. Outgoing r'ship FOUND_IN to/from Pistacia Chinensis (Plant) Rel Props:Reference:
82. Outgoing r'ship FOUND_IN to/from Polygala Chinensis (Plant) Rel Props:Reference:
83. Outgoing r'ship FOUND_IN to/from Potentilla Chinensis (Plant) Rel Props:Reference:
84. Outgoing r'ship FOUND_IN to/from Pothos Chinensis (Plant) Rel Props:Reference:
85. Outgoing r'ship FOUND_IN to/from Pothos Scandens (Plant) Rel Props:Reference:
86. Outgoing r'ship FOUND_IN to/from Pulsatilla Chinensis (Plant) Rel Props:Reference:
87. Outgoing r'ship FOUND_IN to/from Rhodotypos Scandens (Plant) Rel Props:Reference:
88. Outgoing r'ship FOUND_IN to/from Rhus Chinensis (Plant) Rel Props:Reference:
89. Outgoing r'ship FOUND_IN to/from Ribes Alpinum (Plant) Rel Props:Reference:
90. Outgoing r'ship FOUND_IN to/from Ribes Fasciculatum (Plant) Rel Props:Reference:
91. Outgoing r'ship FOUND_IN to/from Ribes Himalense (Plant) Rel Props:Reference:
92. Outgoing r'ship FOUND_IN to/from Ribes Nigrum (Plant) Rel Props:Reference:
93. Outgoing r'ship FOUND_IN to/from Ribes Orientale (Plant) Rel Props:Reference:
94. Outgoing r'ship FOUND_IN to/from Ribes Rubrum (Plant) Rel Props:Reference:
95. Outgoing r'ship FOUND_IN to/from Ribes Sanguineum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
96. Outgoing r'ship FOUND_IN to/from Rosa Chinensis (Plant) Rel Props:Reference:
97. Outgoing r'ship FOUND_IN to/from Salacia Chinensis (Plant) Rel Props:Reference:
98. Outgoing r'ship FOUND_IN to/from Saururus Chinensis (Plant) Rel Props:Reference:
99. Outgoing r'ship FOUND_IN to/from Schisandra Chinensis (Plant) Rel Props:Reference:
100. Outgoing r'ship FOUND_IN to/from Scolopia Chinensis (Plant) Rel Props:Reference:
101. Outgoing r'ship FOUND_IN to/from Scutellaria Scandens (Plant) Rel Props:Reference:
102. Outgoing r'ship FOUND_IN to/from Senecio Chinensis (Plant) Rel Props:Reference:
103. Outgoing r'ship FOUND_IN to/from Senecio Scandens (Plant) Rel Props:Reference:
104. Outgoing r'ship FOUND_IN to/from Simmondsia Chinensis (Plant) Rel Props:Reference:
105. Outgoing r'ship FOUND_IN to/from Siphonostegia Chinensis (Plant) Rel Props:Reference:
106. Outgoing r'ship FOUND_IN to/from Solidago Chinensis (Plant) Rel Props:Reference:
107. Outgoing r'ship FOUND_IN to/from Sphenomeris Chinensis (Plant) Rel Props:Reference:
108. Outgoing r'ship FOUND_IN to/from Stachys Aegyptiaca (Plant) Rel Props:Reference:
109. Outgoing r'ship FOUND_IN to/from Stachys Affinis (Plant) Rel Props:Reference:
110. Outgoing r'ship FOUND_IN to/from Stachys Byzantina (Plant) Rel Props:Reference:
111. Outgoing r'ship FOUND_IN to/from Stachys Chinensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
112. Outgoing r'ship FOUND_IN to/from Stachys Lavandulifolia (Plant) Rel Props:Reference:
113. Outgoing r'ship FOUND_IN to/from Stachys Mucronata (Plant) Rel Props:Reference:
114. Outgoing r'ship FOUND_IN to/from Stachys Palustris (Plant) Rel Props:Reference:
115. Outgoing r'ship FOUND_IN to/from Stachys Plumosa (Plant) Rel Props:Reference:
116. Outgoing r'ship FOUND_IN to/from Stachys Sylvatica (Plant) Rel Props:Reference:
117. Outgoing r'ship FOUND_IN to/from Stachys Tibetica (Plant) Rel Props:Reference:
118. Outgoing r'ship FOUND_IN to/from Stachys Tuberifera (Plant) Rel Props:Reference:
119. Outgoing r'ship FOUND_IN to/from Stauntonia Chinensis (Plant) Rel Props:Reference:
120. Outgoing r'ship FOUND_IN to/from Swertia Chinensis (Plant) Rel Props:Reference:
121. Outgoing r'ship FOUND_IN to/from Symplocos Chinensis (Plant) Rel Props:Reference:
122. Outgoing r'ship FOUND_IN to/from Tamarix Chinensis (Plant) Rel Props:Reference:
123. Outgoing r'ship FOUND_IN to/from Taxillus Chinensis (Plant) Rel Props:Reference:
124. Outgoing r'ship FOUND_IN to/from Taxus Chinensis (Plant) Rel Props:Reference:
125. Outgoing r'ship FOUND_IN to/from Tetracera Scandens (Plant) Rel Props:Reference:
126. Outgoing r'ship FOUND_IN to/from Thermopsis Chinensis (Plant) Rel Props:Reference:
127. Outgoing r'ship FOUND_IN to/from Trollius Chinensis (Plant) Rel Props:Reference:
128. Outgoing r'ship FOUND_IN to/from Tsuga Chinensis (Plant) Rel Props:Reference:
129. Outgoing r'ship FOUND_IN to/from Tupistra Chinensis (Plant) Rel Props:Reference:
130. Outgoing r'ship FOUND_IN to/from Uncaria Scandens (Plant) Rel Props:Reference:
131. Outgoing r'ship FOUND_IN to/from Valeriana Jatamansi (Plant) Rel Props:Reference:
132. Outgoing r'ship FOUND_IN to/from Wedelia Chinensis (Plant) Rel Props:Reference:

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(4R,4aS,5R)-4-hydroxy-4a,5-dimethyl-5,6-dihydro-4H-naphthalene-1,7-dione

Graph

Phytochemical Properties

Associated Connections 132

Plant Connections 132