Swerchirin

PubChem CID: 5281660

Connections displayed (default: 10).

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Compound Synonyms	Swerchirin, Methylbellidifolin, 521-65-3, 5-O-Methylbellidifolin, 1,8-Dihydroxy-3,5-dimethoxyxanthen-9-one, 1,8-Dihydroxy-3,5-dimethoxy-9H-xanthen-9-one, Xanthen-9-one, 1,8-dihydroxy-3,5-dimethoxy-, QQB9X426DM, 3,5-Dimethoxy-1,8-dihydroxyxanthone, BRN 0313581, 1,8-dihydroxy-3,5-dimethoxyxanthone, 9H-Xanthen-9-one, 1,8-dihydroxy-3,5-dimethoxy-, 1,8-dihydroxy-3,5-dimethoxyxanthenone, 1,8-dihydroxy-3,5-dimethoxy-xanthenone, CHEBI:9368, DTXSID80200102, 5-18-05-00194 (Beilstein Handbook Reference), 1,8-dihydroxy-3,5-dimethoxy-xanthen-9-one, UNII-QQB9X426DM, SCHEMBL18240051, DTXCID40122593, AKOS040754119, Q27089378
Ghose Rule	True
Classyfire Kingdom	Organic compounds
Topological Polar Surface Area	85.2
Hydrogen Bond Donor Count	2.0
Pfizer 3 75 Rule	True
Scaffold Graph Level	CC1C2CCCCC2CC2CCCCC21
Np Classifier Class	Plant xanthones
Deep Smiles	COcccO)ccc6)occc6=O))cO)ccc6OC
Heavy Atom Count	21.0
Classyfire Class	Benzopyrans
Scaffold Graph Node Level	OC1C2CCCCC2OC2CCCCC21
Classyfire Subclass	1-benzopyrans
Isotope Atom Count	0.0
Molecular Complexity	400.0
Database Name	cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Iupac Name	1,8-dihydroxy-3,5-dimethoxyxanthen-9-one
Prediction Hob	1.0
Veber Rule	True
Classyfire Superclass	Organoheterocyclic compounds
Xlogp	2.7
Gsk 4 400 Rule	True
Molecular Formula	C15H12O6
Scaffold Graph Node Bond Level	O=c1c2ccccc2oc2ccccc12
Prediction Swissadme	0.0
Inchi Key	GNSHHHWDGOHNPC-UHFFFAOYSA-N
Silicos It Class	Moderately soluble
Fcsp3	0.1333333333333333
Logs	-3.732
Rotatable Bond Count	2.0
Logd	2.714
Synonyms	1,8-dihydroxy-3,5-dimethoxy-xanthone(swerchirin), swerchirin
Esol Class	Soluble
Functional Groups	c=O, cO, cOC, coc
Compound Name	Swerchirin
Prediction Hob Swissadme	0.0
Exact Mass	288.063
Formal Charge	0.0
Monoisotopic Mass	288.063
Hydrogen Bond Acceptor Count	6.0
Molecular Weight	288.25
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	-4.061214333333334
Inchi	InChI=1S/C15H12O6/c1-19-7-5-9(17)12-11(6-7)21-15-10(20-2)4-3-8(16)13(15)14(12)18/h3-6,16-17H,1-2H3
Smiles	COC1=C2C(=C(C=C1)O)C(=O)C3=C(C=C(C=C3O2)OC)O
Nring	3.0
Np Classifier Biosynthetic Pathway	Polyketides, Shikimates and Phenylpropanoids
Defined Bond Stereocenter Count	0.0
Egan Rule	True
Np Classifier Superclass	Xanthones

1. Outgoing r'ship FOUND_IN to/from Aglaia Laxiflora (Plant) Rel Props:Reference:
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84. Outgoing r'ship FOUND_IN to/from Hedyotis Umbellata (Plant) Rel Props:Reference:
85. Outgoing r'ship FOUND_IN to/from Hunteria Zeylanica (Plant) Rel Props:Reference:
86. Outgoing r'ship FOUND_IN to/from Hydrangea Umbellata (Plant) Rel Props:Reference:
87. Outgoing r'ship FOUND_IN to/from Iris Lactea (Plant) Rel Props:Reference:
88. Outgoing r'ship FOUND_IN to/from Isodon Eriocalyx (Plant) Rel Props:Reference:
89. Outgoing r'ship FOUND_IN to/from Kydia Calycina (Plant) Rel Props:Reference:
90. Outgoing r'ship FOUND_IN to/from Lindera Umbellata (Plant) Rel Props:Reference:
91. Outgoing r'ship FOUND_IN to/from Mangifera Sylvatica (Plant) Rel Props:Reference:
92. Outgoing r'ship FOUND_IN to/from Merremia Umbellata (Plant) Rel Props:Reference:
93. Outgoing r'ship FOUND_IN to/from Meyna Laxiflora (Plant) Rel Props:Reference:
94. Outgoing r'ship FOUND_IN to/from Morinda Umbellata (Plant) Rel Props:Reference:
95. Outgoing r'ship FOUND_IN to/from Nyssa Sylvatica (Plant) Rel Props:Reference:
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99. Outgoing r'ship FOUND_IN to/from Podocarpus Hallii (Plant) Rel Props:Reference:
100. Outgoing r'ship FOUND_IN to/from Rapanea Umbellata (Plant) Rel Props:Reference:
101. Outgoing r'ship FOUND_IN to/from Reseda Luteola (Plant) Rel Props:Reference:
102. Outgoing r'ship FOUND_IN to/from Rhynchosia Cana (Plant) Rel Props:Reference:
103. Outgoing r'ship FOUND_IN to/from Salvia Cana (Plant) Rel Props:Reference:
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105. Outgoing r'ship FOUND_IN to/from Stillingia Sylvatica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
106. Outgoing r'ship FOUND_IN to/from Swertia Alata (Plant) Rel Props:Reference:
107. Outgoing r'ship FOUND_IN to/from Swertia Angustifolia (Plant) Rel Props:Reference:
108. Outgoing r'ship FOUND_IN to/from Swertia Bimaculata (Plant) Rel Props:Reference:
109. Outgoing r'ship FOUND_IN to/from Swertia Calycina (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
110. Outgoing r'ship FOUND_IN to/from Swertia Chinensis (Plant) Rel Props:Reference:
111. Outgoing r'ship FOUND_IN to/from Swertia Chirata (Plant) Rel Props:Source_db:npass_chem_all
112. Outgoing r'ship FOUND_IN to/from Swertia Chirayita (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
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135. Outgoing r'ship FOUND_IN to/from Swertia Nervosa (Plant) Rel Props:Reference:
136. Outgoing r'ship FOUND_IN to/from Swertia Paniculata (Plant) Rel Props:Reference:ISBN:9780387706375
137. Outgoing r'ship FOUND_IN to/from Swertia Patens (Plant) Rel Props:Reference:
138. Outgoing r'ship FOUND_IN to/from Swertia Perennis (Plant) Rel Props:Reference:
139. Outgoing r'ship FOUND_IN to/from Swertia Petiolata (Plant) Rel Props:Reference:
140. Outgoing r'ship FOUND_IN to/from Swertia Pseudochinensis (Plant) Rel Props:Reference:
141. Outgoing r'ship FOUND_IN to/from Swertia Pubescens (Plant) Rel Props:Reference:
142. Outgoing r'ship FOUND_IN to/from Swertia Pulchella (Plant) Rel Props:Reference:
143. Outgoing r'ship FOUND_IN to/from Swertia Punctata (Plant) Rel Props:Reference:
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145. Outgoing r'ship FOUND_IN to/from Swertia Purpurascens (Plant) Rel Props:Reference:
146. Outgoing r'ship FOUND_IN to/from Swertia Randainensis (Plant) Rel Props:Reference:
147. Outgoing r'ship FOUND_IN to/from Swertia Spaciosa (Plant) Rel Props:Reference:
148. Outgoing r'ship FOUND_IN to/from Swertia Swertiopsis (Plant) Rel Props:Reference:
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150. Outgoing r'ship FOUND_IN to/from Swertia Thomsonii (Plant) Rel Props:Reference:
151. Outgoing r'ship FOUND_IN to/from Swertia Tosaensis (Plant) Rel Props:Reference:
152. Outgoing r'ship FOUND_IN to/from Tephrosia Apollinea (Plant) Rel Props:Reference:
153. Outgoing r'ship FOUND_IN to/from Tephrosia Candida (Plant) Rel Props:Reference:
154. Outgoing r'ship FOUND_IN to/from Tephrosia Falciformis (Plant) Rel Props:Reference:
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158. Outgoing r'ship FOUND_IN to/from Tephrosia Spinosa (Plant) Rel Props:Reference:
159. Outgoing r'ship FOUND_IN to/from Tephrosia Uniflora (Plant) Rel Props:Reference:
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162. Outgoing r'ship FOUND_IN to/from Valeriana Laxiflora (Plant) Rel Props:Reference:
163. Outgoing r'ship FOUND_IN to/from Ventilago Calycina (Plant) Rel Props:Reference:
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166. Outgoing r'ship FOUND_IN to/from Zehneria Umbellata (Plant) Rel Props:Reference:

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Phytochemical Properties

Associated Connections 166

Plant Connections 166