Kanugin

PubChem CID: 12305452

Connections displayed (default: 10).

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Compound Synonyms	Kanugin, 3,7-dimethoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)chromen-4-one, CHEMBL3581067, CHEBI:188948, LMPK12111578, 574-03-8, 3,7,3'-trimethoxy-4',5'-methylenedioxyflavone
Ghose Rule	True
Classyfire Kingdom	Organic compounds
Topological Polar Surface Area	72.5
Hydrogen Bond Donor Count	0.0
Pfizer 3 75 Rule	False
Scaffold Graph Level	CC1CC(C2CCC3CCCC3C2)CC2CCCCC12
Np Classifier Class	Flavonols
Deep Smiles	COcccccc6)occc6=O))OC)))cccOC))ccc6)OCO5
Heavy Atom Count	26.0
Classyfire Class	Flavonoids
Scaffold Graph Node Level	OC1CC(C2CCC3OCOC3C2)OC2CCCCC12
Classyfire Subclass	O-methylated flavonoids
Isotope Atom Count	0.0
Molecular Complexity	574.0
Database Name	cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Iupac Name	3,7-dimethoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)chromen-4-one
Prediction Hob	1.0
Veber Rule	True
Classyfire Superclass	Phenylpropanoids and polyketides
Xlogp	3.1
Gsk 4 400 Rule	True
Molecular Formula	C19H16O7
Scaffold Graph Node Bond Level	O=c1cc(-c2ccc3c(c2)OCO3)oc2ccccc12
Prediction Swissadme	0.0
Inchi Key	HZHNYQLMLQAKSH-UHFFFAOYSA-N
Silicos It Class	Poorly soluble
Fcsp3	0.2105263157894736
Logs	-5.225
Rotatable Bond Count	4.0
Logd	3.244
Synonyms	kanugin
Esol Class	Moderately soluble
Functional Groups	c1cOCO1, c=O, cOC, coc
Compound Name	Kanugin
Prediction Hob Swissadme	0.0
Exact Mass	356.09
Formal Charge	0.0
Monoisotopic Mass	356.09
Hydrogen Bond Acceptor Count	7.0
Molecular Weight	356.3
Gi Absorption	True
Covalent Unit Count	1.0
Total Atom Stereocenter Count	0.0
Total Bond Stereocenter Count	0.0
Lipinski Rule Of 5	True
Esol	-3.840830615384616
Inchi	InChI=1S/C19H16O7/c1-21-11-4-5-12-13(8-11)26-17(19(23-3)16(12)20)10-6-14(22-2)18-15(7-10)24-9-25-18/h4-8H,9H2,1-3H3
Smiles	COC1=CC2=C(C=C1)C(=O)C(=C(O2)C3=CC4=C(C(=C3)OC)OCO4)OC
Nring	4.0
Np Classifier Biosynthetic Pathway	Shikimates and Phenylpropanoids
Defined Bond Stereocenter Count	0.0
Egan Rule	True
Np Classifier Superclass	Flavonoids

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66. Outgoing r'ship FOUND_IN to/from Hymenoxys Insignis (Plant) Rel Props:Reference:
67. Outgoing r'ship FOUND_IN to/from Jacobaea Maritima (Plant) Rel Props:Reference:
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74. Outgoing r'ship FOUND_IN to/from Metrodorea Nigra (Plant) Rel Props:Reference:
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77. Outgoing r'ship FOUND_IN to/from Morus Nigra (Plant) Rel Props:Reference:
78. Outgoing r'ship FOUND_IN to/from Munronia Pinnata (Plant) Rel Props:Reference:
79. Outgoing r'ship FOUND_IN to/from Nux Vomica (Plant) Rel Props:Reference:
80. Outgoing r'ship FOUND_IN to/from Ozoroa Insignis (Plant) Rel Props:Reference:
81. Outgoing r'ship FOUND_IN to/from Parishia Insignis (Plant) Rel Props:Reference:
82. Outgoing r'ship FOUND_IN to/from Paullinia Pinnata (Plant) Rel Props:Reference:
83. Outgoing r'ship FOUND_IN to/from Pimpinella Diversifolia (Plant) Rel Props:Reference:
84. Outgoing r'ship FOUND_IN to/from Platonia Insignis (Plant) Rel Props:Reference:
85. Outgoing r'ship FOUND_IN to/from Pongamia Glabra (Plant) Rel Props:Reference:
86. Outgoing r'ship FOUND_IN to/from Pongamia Pinnata (Plant) Rel Props:Source_db:npass_chem_all
87. Outgoing r'ship FOUND_IN to/from Populus Nigra (Plant) Rel Props:Reference:
88. Outgoing r'ship FOUND_IN to/from Pulicaria Insignis (Plant) Rel Props:Reference:
89. Outgoing r'ship FOUND_IN to/from Quamoclit Pinnata (Plant) Rel Props:Reference:
90. Outgoing r'ship FOUND_IN to/from Remirea Maritima (Plant) Rel Props:Reference:
91. Outgoing r'ship FOUND_IN to/from Rosa Agrestis (Plant) Rel Props:Reference:
92. Outgoing r'ship FOUND_IN to/from Ruta Pinnata (Plant) Rel Props:Reference:
93. Outgoing r'ship FOUND_IN to/from Salix Nigra (Plant) Rel Props:Reference:
94. Outgoing r'ship FOUND_IN to/from Sambucus Nigra (Plant) Rel Props:Reference:
95. Outgoing r'ship FOUND_IN to/from Sapondius Pinnata (Plant) Rel Props:Reference:
96. Outgoing r'ship FOUND_IN to/from Saxifraga Diversifolia (Plant) Rel Props:Reference:
97. Outgoing r'ship FOUND_IN to/from Schisandra Nigra (Plant) Rel Props:Reference:
98. Outgoing r'ship FOUND_IN to/from Schkuhria Pinnata (Plant) Rel Props:Reference:
99. Outgoing r'ship FOUND_IN to/from Scilla Maritima (Plant) Rel Props:Reference:
100. Outgoing r'ship FOUND_IN to/from Sinapis Nigra (Plant) Rel Props:Reference:
101. Outgoing r'ship FOUND_IN to/from Spondias Pinnata (Plant) Rel Props:Reference:
102. Outgoing r'ship FOUND_IN to/from Stemodia Maritima (Plant) Rel Props:Reference:
103. Outgoing r'ship FOUND_IN to/from Strychnos Aculeata (Plant) Rel Props:Reference:
104. Outgoing r'ship FOUND_IN to/from Strychnos Aenea (Plant) Rel Props:Reference:
105. Outgoing r'ship FOUND_IN to/from Strychnos Afzelii (Plant) Rel Props:Reference:
106. Outgoing r'ship FOUND_IN to/from Strychnos Amazonica (Plant) Rel Props:Reference:
107. Outgoing r'ship FOUND_IN to/from Strychnos Angustiflora (Plant) Rel Props:Reference:
108. Outgoing r'ship FOUND_IN to/from Strychnos Camptoneura (Plant) Rel Props:Reference:
109. Outgoing r'ship FOUND_IN to/from Strychnos Cathayensis (Plant) Rel Props:Reference:
110. Outgoing r'ship FOUND_IN to/from Strychnos Colubrina (Plant) Rel Props:Reference:
111. Outgoing r'ship FOUND_IN to/from Strychnos Decussata (Plant) Rel Props:Reference:
112. Outgoing r'ship FOUND_IN to/from Strychnos Diplotricha (Plant) Rel Props:Reference:
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114. Outgoing r'ship FOUND_IN to/from Strychnos Elaeocarpa (Plant) Rel Props:Reference:
115. Outgoing r'ship FOUND_IN to/from Strychnos Erichsonii (Plant) Rel Props:Reference:
116. Outgoing r'ship FOUND_IN to/from Strychnos Fendleri (Plant) Rel Props:Reference:
117. Outgoing r'ship FOUND_IN to/from Strychnos Froesii (Plant) Rel Props:Reference:
118. Outgoing r'ship FOUND_IN to/from Strychnos Gossweileri (Plant) Rel Props:Reference:
119. Outgoing r'ship FOUND_IN to/from Strychnos Henningsii (Plant) Rel Props:Reference:
120. Outgoing r'ship FOUND_IN to/from Strychnos Icaja (Plant) Rel Props:Reference:
121. Outgoing r'ship FOUND_IN to/from Strychnos Ignatii (Plant) Rel Props:Reference:
122. Outgoing r'ship FOUND_IN to/from Strychnos Ledermannii (Plant) Rel Props:Reference:
123. Outgoing r'ship FOUND_IN to/from Strychnos Ligustrina (Plant) Rel Props:Reference:
124. Outgoing r'ship FOUND_IN to/from Strychnos Malaccensis (Plant) Rel Props:Reference:
125. Outgoing r'ship FOUND_IN to/from Strychnos Minor (Plant) Rel Props:Reference:
126. Outgoing r'ship FOUND_IN to/from Strychnos Nitida (Plant) Rel Props:Reference:
127. Outgoing r'ship FOUND_IN to/from Strychnos Nux-Vomica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
128. Outgoing r'ship FOUND_IN to/from Strychnos Panamensis (Plant) Rel Props:Reference:
129. Outgoing r'ship FOUND_IN to/from Strychnos Potatorum (Plant) Rel Props:Reference:
130. Outgoing r'ship FOUND_IN to/from Strychnos Spinosa (Plant) Rel Props:Reference:
131. Outgoing r'ship FOUND_IN to/from Strychnos Splendens (Plant) Rel Props:Reference:
132. Outgoing r'ship FOUND_IN to/from Strychnos Staudtii (Plant) Rel Props:Reference:
133. Outgoing r'ship FOUND_IN to/from Strychnos Tabascana (Plant) Rel Props:Reference:
134. Outgoing r'ship FOUND_IN to/from Strychnos Tomentosa (Plant) Rel Props:Reference:
135. Outgoing r'ship FOUND_IN to/from Strychnos Tricalysioides (Plant) Rel Props:Reference:
136. Outgoing r'ship FOUND_IN to/from Strychnos Triplinervia (Plant) Rel Props:Reference:
137. Outgoing r'ship FOUND_IN to/from Strychnos Usambarensis (Plant) Rel Props:Reference:
138. Outgoing r'ship FOUND_IN to/from Strychnos Vanprukii (Plant) Rel Props:Reference:
139. Outgoing r'ship FOUND_IN to/from Strychnos Wallichiana (Plant) Rel Props:Reference:
140. Outgoing r'ship FOUND_IN to/from Styrax Agrestis (Plant) Rel Props:Reference:
141. Outgoing r'ship FOUND_IN to/from Suaeda Maritima (Plant) Rel Props:Reference:
142. Outgoing r'ship FOUND_IN to/from Suregada Lanceolata (Plant) Rel Props:Reference:ISBN:9770972795006
143. Outgoing r'ship FOUND_IN to/from Tithonia Diversifolia (Plant) Rel Props:Reference:
144. Outgoing r'ship FOUND_IN to/from Triglochin Maritima (Plant) Rel Props:Reference:
145. Outgoing r'ship FOUND_IN to/from Tsuga Diversifolia (Plant) Rel Props:Reference:
146. Outgoing r'ship FOUND_IN to/from Vitex Pinnata (Plant) Rel Props:Reference:

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Kanugin

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Phytochemical Properties

Associated Connections 146

Plant Connections 146