3,4-Dimethoxydalbergione

PubChem CID: 115019

Connections displayed (default: 10).

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Compound Synonyms	3,4-Dimethoxydalbergione, (R)-3,4-Dimethoxydalbergione, 3755-64-4, 2,3-dimethoxy-5-[(1R)-1-phenylprop-2-enyl]cyclohexa-2,5-diene-1,4-dione, (R)-2,3-Dimethoxy-5-(1-phenylallyl)cyclohexa-2,5-diene-1,4-dione, Spectrum_000558, SpecPlus_000112, Spectrum2_000304, Spectrum4_001593, Spectrum5_000306, KBioGR_002206, KBioSS_001038, SPECTRUM240828, DivK1c_006208, SPBio_000268, CHEMBL1591258, SCHEMBL17131830, KBio1_001152, KBio2_001038, KBio2_003606, KBio2_006174, DTXSID70958625, CHEBI:185140, GLXC-20643, CCG-38581, LMPK12100076, SC1475, 2,3-Dimethoxy-5-((1R)-1-phenyl-2-propenyl)-2,5-cyclohexadiene-1,4-dione, SDCCGMLS-0066545.P001, NCGC00160161-01, SR-05000002540, SR-05000002540-1, BRD-K84463716-001-02-5, 2,3-dimethoxy-5-[(1R)-1-phenylallyl]-1,4-benzoquinone, 2,3-dimethoxy-5-(1-phenylprop-2-en-1-yl)cyclohexa-2,5-diene-1,4-dione, 2,5-Cyclohexadiene-1,4-dione, 2,3-dimethoxy-5-(1-phenyl-2-propenyl)-, (R)-
Topological Polar Surface Area	52.6
Hydrogen Bond Donor Count	0.0
Heavy Atom Count	21.0
Isotope Atom Count	0.0
Molecular Complexity	507.0
Database Name	cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count	1.0
Uniprot Id	B2RXH2, P10636, P51450, Q9F4F7, P97697, O97447, P15428, P11473, Q9NUW8, Q9Y6L6, Q9NPD5
Iupac Name	2,3-dimethoxy-5-[(1R)-1-phenylprop-2-enyl]cyclohexa-2,5-diene-1,4-dione
Prediction Hob	1.0
Target Id	NPT48, NPT51, NPT151
Xlogp	2.9
Molecular Formula	C17H16O4
Prediction Swissadme	0.0
Inchi Key	LJEJBLOFFDLRIH-GFCCVEGCSA-N
Fcsp3	0.1764705882352941
Logs	-4.256
Rotatable Bond Count	5.0
Logd	2.037
Compound Name	3,4-Dimethoxydalbergione
Prediction Hob Swissadme	0.0
Exact Mass	284.105
Formal Charge	0.0
Monoisotopic Mass	284.105
Hydrogen Bond Acceptor Count	4.0
Molecular Weight	284.31
Covalent Unit Count	1.0
Total Atom Stereocenter Count	1.0
Total Bond Stereocenter Count	0.0
Esol	-3.348956771428571
Inchi	InChI=1S/C17H16O4/c1-4-12(11-8-6-5-7-9-11)13-10-14(18)16(20-2)17(21-3)15(13)19/h4-10,12H,1H2,2-3H3/t12-/m1/s1
Smiles	COC1=C(C(=O)C(=CC1=O)[C@H](C=C)C2=CC=CC=C2)OC
Nring	2.0
Defined Bond Stereocenter Count	0.0

1. Outgoing r'ship FOUND_IN to/from Abutilon Indicum (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Acacia Caesia (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Alpina Galanga (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Alpinia Galanga (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Ammannia Auriculata (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Anthemis Auriculata (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Aplotaxis Auriculata (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Arnica Foliosa (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Arnica Longifolia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
10. Outgoing r'ship FOUND_IN to/from Arnica Mollis (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Arnica Montana (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Arnica Nevadensis (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Arnica Parryi (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Arnica Sachalinensis (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Arnica Viscosa (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Artanema Longifolia (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Arthrocnemum Indicum (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Artocarpus Rigidus (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Asteracantha Longifolia (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Bassia Longifolia (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Brickellia Longifolia (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Bryodesma Indicum (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Callicarpa Longifolia (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Callistemon Rigidus (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Canarium Indicum (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Cassia Auriculata (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Cerastium Indicum (Plant) Rel Props:Reference:
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29. Outgoing r'ship FOUND_IN to/from Chrysanthemum Indicum (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Claoxylon Indicum (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Clerodendron Indicum (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Clerodendrum Bracteatum (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Clerodendrum Bungei (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Clerodendrum Calamitosum (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Clerodendrum Chinense (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Clerodendrum Colebrookianum (Plant) Rel Props:Reference:
37. Outgoing r'ship FOUND_IN to/from Clerodendrum Cyrtophyllum (Plant) Rel Props:Reference:
38. Outgoing r'ship FOUND_IN to/from Clerodendrum Glandulosum (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Clerodendrum Indicum (Plant) Rel Props:Source_db:npass_chem_all
40. Outgoing r'ship FOUND_IN to/from Clerodendrum Infortunatum (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Clerodendrum Japonicum (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Clerodendrum Kaempferi (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Clerodendrum L (Plant) Rel Props:Reference:
44. Outgoing r'ship FOUND_IN to/from Clerodendrum Laevifolium (Plant) Rel Props:Reference:
45. Outgoing r'ship FOUND_IN to/from Clerodendrum Paniculatum (Plant) Rel Props:Reference:
46. Outgoing r'ship FOUND_IN to/from Clerodendrum Philippinum (Plant) Rel Props:Reference:
47. Outgoing r'ship FOUND_IN to/from Clerodendrum Phlomidis (Plant) Rel Props:Reference:
48. Outgoing r'ship FOUND_IN to/from Clerodendrum Serratum (Plant) Rel Props:Reference:
49. Outgoing r'ship FOUND_IN to/from Clerodendrum Siphonanthus (Plant) Rel Props:Reference:
50. Outgoing r'ship FOUND_IN to/from Clerodendrum Splendens (Plant) Rel Props:Reference:
51. Outgoing r'ship FOUND_IN to/from Clerodendrum Tomentosum (Plant) Rel Props:Reference:
52. Outgoing r'ship FOUND_IN to/from Clerodendrum Trichotomum (Plant) Rel Props:Reference:
53. Outgoing r'ship FOUND_IN to/from Clerodendrum Umbellatum (Plant) Rel Props:Reference:
54. Outgoing r'ship FOUND_IN to/from Clerodendrum Viscosum (Plant) Rel Props:Reference:
55. Outgoing r'ship FOUND_IN to/from Clerodendrum Volubile (Plant) Rel Props:Reference:
56. Outgoing r'ship FOUND_IN to/from Combretum Indicum (Plant) Rel Props:Reference:
57. Outgoing r'ship FOUND_IN to/from Cryptocarya Longifolia (Plant) Rel Props:Reference:
58. Outgoing r'ship FOUND_IN to/from Cucurma Longifolia (Plant) Rel Props:Reference:
59. Outgoing r'ship FOUND_IN to/from Curcuma Caesia (Plant) Rel Props:Reference:
60. Outgoing r'ship FOUND_IN to/from Debregeasia Longifolia (Plant) Rel Props:Reference:
61. Outgoing r'ship FOUND_IN to/from Distemon Indicum (Plant) Rel Props:Reference:
62. Outgoing r'ship FOUND_IN to/from Ehretia Canarensis (Plant) Rel Props:Reference:
63. Outgoing r'ship FOUND_IN to/from Eurycoma Longifolia (Plant) Rel Props:Reference:
64. Outgoing r'ship FOUND_IN to/from Ficus Auriculata (Plant) Rel Props:Reference:
65. Outgoing r'ship FOUND_IN to/from Gnaphalium Indicum (Plant) Rel Props:Reference:
66. Outgoing r'ship FOUND_IN to/from Gossypium Indicum (Plant) Rel Props:Reference:
67. Outgoing r'ship FOUND_IN to/from Heliophylum Indicum (Plant) Rel Props:Reference:
68. Outgoing r'ship FOUND_IN to/from Heliotropium Indicum (Plant) Rel Props:Reference:
69. Outgoing r'ship FOUND_IN to/from Holigarna Longifolia (Plant) Rel Props:Reference:
70. Outgoing r'ship FOUND_IN to/from Hygrophila Auriculata (Plant) Rel Props:Reference:
71. Outgoing r'ship FOUND_IN to/from Kaempferia Angustifolia (Plant) Rel Props:Reference:
72. Outgoing r'ship FOUND_IN to/from Kaempferia Galanga (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
73. Outgoing r'ship FOUND_IN to/from Kaempferia Marginata (Plant) Rel Props:Reference:
74. Outgoing r'ship FOUND_IN to/from Kaempferia Pandurata (Plant) Rel Props:Reference:
75. Outgoing r'ship FOUND_IN to/from Kaempferia Pulchra (Plant) Rel Props:Reference:
76. Outgoing r'ship FOUND_IN to/from Kaempferia Rotunda (Plant) Rel Props:Reference:
77. Outgoing r'ship FOUND_IN to/from Kaempferia Roturela (Plant) Rel Props:Reference:
78. Outgoing r'ship FOUND_IN to/from Limeum Indicum (Plant) Rel Props:Reference:
79. Outgoing r'ship FOUND_IN to/from Limnanthemum Indicum (Plant) Rel Props:Reference:
80. Outgoing r'ship FOUND_IN to/from Madhuca Longifolia (Plant) Rel Props:Reference:
81. Outgoing r'ship FOUND_IN to/from Mammea Longifolia (Plant) Rel Props:Reference:
82. Outgoing r'ship FOUND_IN to/from Melanthium Indicum (Plant) Rel Props:Reference:
83. Outgoing r'ship FOUND_IN to/from Melilotus Indicum (Plant) Rel Props:Reference:
84. Outgoing r'ship FOUND_IN to/from Mentha Longifolia (Plant) Rel Props:Reference:
85. Outgoing r'ship FOUND_IN to/from Michelia Longifolia (Plant) Rel Props:Reference:
86. Outgoing r'ship FOUND_IN to/from Millettia Auriculata (Plant) Rel Props:Reference:
87. Outgoing r'ship FOUND_IN to/from Morina Longifolia (Plant) Rel Props:Reference:
88. Outgoing r'ship FOUND_IN to/from Mycetia Longifolia (Plant) Rel Props:Reference:
89. Outgoing r'ship FOUND_IN to/from Nasturtium Indicum (Plant) Rel Props:Reference:
90. Outgoing r'ship FOUND_IN to/from Nerium Indicum (Plant) Rel Props:Reference:
91. Outgoing r'ship FOUND_IN to/from Nymphoides Indicum (Plant) Rel Props:Reference:
92. Outgoing r'ship FOUND_IN to/from Oroxylum Indicum (Plant) Rel Props:Reference:
93. Outgoing r'ship FOUND_IN to/from Pajanelia Longifolia (Plant) Rel Props:Reference:
94. Outgoing r'ship FOUND_IN to/from Pentanema Indicum (Plant) Rel Props:Reference:
95. Outgoing r'ship FOUND_IN to/from Phyllocephalum Indicum (Plant) Rel Props:Reference:
96. Outgoing r'ship FOUND_IN to/from Physalis Longifolia (Plant) Rel Props:Reference:
97. Outgoing r'ship FOUND_IN to/from Pinus Longifolia (Plant) Rel Props:Reference:
98. Outgoing r'ship FOUND_IN to/from Plumbago Auriculata (Plant) Rel Props:Source_db:npass_chem_all
99. Outgoing r'ship FOUND_IN to/from Plumbago Europaea (Plant) Rel Props:Reference:
100. Outgoing r'ship FOUND_IN to/from Plumbago Indica (Plant) Rel Props:Reference:
101. Outgoing r'ship FOUND_IN to/from Plumbago Pulchella (Plant) Rel Props:Reference:
102. Outgoing r'ship FOUND_IN to/from Plumbago Rosea (Plant) Rel Props:Reference:
103. Outgoing r'ship FOUND_IN to/from Plumbago Zeylanica (Plant) Rel Props:Reference:
104. Outgoing r'ship FOUND_IN to/from Poeciloneuron Indicum (Plant) Rel Props:Reference:
105. Outgoing r'ship FOUND_IN to/from Polyalthia Longifolia (Plant) Rel Props:Reference:
106. Outgoing r'ship FOUND_IN to/from Polygala Longifolia (Plant) Rel Props:Reference:
107. Outgoing r'ship FOUND_IN to/from Polythia Longifolia (Plant) Rel Props:Reference:
108. Outgoing r'ship FOUND_IN to/from Rubus Adenotrichos (Plant) Rel Props:Reference:
109. Outgoing r'ship FOUND_IN to/from Rubus Alceifolius (Plant) Rel Props:Reference:
110. Outgoing r'ship FOUND_IN to/from Rubus Barberi (Plant) Rel Props:Reference:
111. Outgoing r'ship FOUND_IN to/from Rubus Biflorus (Plant) Rel Props:Reference:
112. Outgoing r'ship FOUND_IN to/from Rubus Chingii (Plant) Rel Props:Reference:
113. Outgoing r'ship FOUND_IN to/from Rubus Chroosepalus (Plant) Rel Props:Reference:
114. Outgoing r'ship FOUND_IN to/from Rubus Coreanus (Plant) Rel Props:Reference:
115. Outgoing r'ship FOUND_IN to/from Rubus Ellipticus (Plant) Rel Props:Reference:
116. Outgoing r'ship FOUND_IN to/from Rubus Foliolatus (Plant) Rel Props:Reference:
117. Outgoing r'ship FOUND_IN to/from Rubus Foliolosus (Plant) Rel Props:Reference:
118. Outgoing r'ship FOUND_IN to/from Rubus Fruticosus (Plant) Rel Props:Reference:
119. Outgoing r'ship FOUND_IN to/from Rubus Glaucus (Plant) Rel Props:Reference:
120. Outgoing r'ship FOUND_IN to/from Rubus Hirsutus (Plant) Rel Props:Reference:
121. Outgoing r'ship FOUND_IN to/from Rubus Hoffmeisterianus (Plant) Rel Props:Reference:
122. Outgoing r'ship FOUND_IN to/from Rubus Idaeus (Plant) Rel Props:Reference:
123. Outgoing r'ship FOUND_IN to/from Rubus Koehneanus (Plant) Rel Props:Reference:
124. Outgoing r'ship FOUND_IN to/from Rubus Laciniatus (Plant) Rel Props:Reference:
125. Outgoing r'ship FOUND_IN to/from Rubus Lambertianus (Plant) Rel Props:Reference:
126. Outgoing r'ship FOUND_IN to/from Rubus Moluccanus (Plant) Rel Props:Reference:
127. Outgoing r'ship FOUND_IN to/from Rubus Nepalensis (Plant) Rel Props:Reference:
128. Outgoing r'ship FOUND_IN to/from Rubus Niveus (Plant) Rel Props:Reference:
129. Outgoing r'ship FOUND_IN to/from Rubus Occidentalis (Plant) Rel Props:Reference:
130. Outgoing r'ship FOUND_IN to/from Rubus Parkeri (Plant) Rel Props:Reference:
131. Outgoing r'ship FOUND_IN to/from Rubus Parviforlius (Plant) Rel Props:Reference:
132. Outgoing r'ship FOUND_IN to/from Rubus Pedunculosus (Plant) Rel Props:Reference:
133. Outgoing r'ship FOUND_IN to/from Rubus Phoenicolasius (Plant) Rel Props:Reference:
134. Outgoing r'ship FOUND_IN to/from Rubus Pileatus (Plant) Rel Props:Reference:
135. Outgoing r'ship FOUND_IN to/from Rubus Plicatus (Plant) Rel Props:Reference:
136. Outgoing r'ship FOUND_IN to/from Rubus Pungens (Plant) Rel Props:Reference:
137. Outgoing r'ship FOUND_IN to/from Rubus Rigidus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
138. Outgoing r'ship FOUND_IN to/from Rubus Rosa (Plant) Rel Props:Reference:
139. Outgoing r'ship FOUND_IN to/from Rubus Rugosus (Plant) Rel Props:Reference:
140. Outgoing r'ship FOUND_IN to/from Rubus Sanctus (Plant) Rel Props:Reference:
141. Outgoing r'ship FOUND_IN to/from Rubus Trifidus (Plant) Rel Props:Reference:
142. Outgoing r'ship FOUND_IN to/from Rubus Ulmifolius (Plant) Rel Props:Reference:
143. Outgoing r'ship FOUND_IN to/from Rubus Xanthocarpus (Plant) Rel Props:Reference:
144. Outgoing r'ship FOUND_IN to/from Sandoricum Indicum (Plant) Rel Props:Reference:
145. Outgoing r'ship FOUND_IN to/from Sapium Indicum (Plant) Rel Props:Reference:
146. Outgoing r'ship FOUND_IN to/from Senegalia Catechu (Plant) Rel Props:Reference:
147. Outgoing r'ship FOUND_IN to/from Senegalia Mellifera (Plant) Rel Props:Reference:
148. Outgoing r'ship FOUND_IN to/from Senegalia Pennata (Plant) Rel Props:Reference:
149. Outgoing r'ship FOUND_IN to/from Senegalia Tenuifolia (Plant) Rel Props:Reference:
150. Outgoing r'ship FOUND_IN to/from Senna Auriculata (Plant) Rel Props:Reference:
151. Outgoing r'ship FOUND_IN to/from Sesamum Indicum (Plant) Rel Props:Reference:
152. Outgoing r'ship FOUND_IN to/from Seseli Indicum (Plant) Rel Props:Reference:
153. Outgoing r'ship FOUND_IN to/from Solanum Indicum (Plant) Rel Props:Reference:
154. Outgoing r'ship FOUND_IN to/from Sophora Exigua (Plant) Rel Props:Reference:
155. Outgoing r'ship FOUND_IN to/from Spirotropis Longifolia (Plant) Rel Props:Reference:
156. Outgoing r'ship FOUND_IN to/from Tiaridium Indicum (Plant) Rel Props:Reference:
157. Outgoing r'ship FOUND_IN to/from Trichodesma Indicum (Plant) Rel Props:Reference:
158. Outgoing r'ship FOUND_IN to/from Tricodesma Indicum (Plant) Rel Props:Reference:
159. Outgoing r'ship FOUND_IN to/from Veronica Longifolia (Plant) Rel Props:Reference:
160. Outgoing r'ship FOUND_IN to/from Xanthium Indicum (Plant) Rel Props:Reference:
161. Outgoing r'ship FOUND_IN to/from Xylosma Longifolia (Plant) Rel Props:Reference:

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3,4-Dimethoxydalbergione

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Phytochemical Properties

Associated Connections 161

Plant Connections 161