Milldurone

PubChem CID: 6728947

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Compound Synonyms	Milldurone, 24195-15-1, 6,7-dimethoxy-3-(6-methoxy-1,3-benzodioxol-5-yl)chromen-4-one, SPBio_001886, Spectrum2_001753, CHEMBL234717, SCHEMBL4283565, CCG-38804, LMPK12050125, XM161782, Millduron, 6,7,2'-Trimethoxy-4',5'-methylenedioxyisoflavone, 6,7-Dimethoxy-3-(6-methoxy-1,3-benzodioxol-5-yl)-4H-1-benzopyran-4-one
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	CC1C2CCCCC2CCC1C1CCC2CCCC2C1
Np Classifier Class	Isoflavones
Deep Smiles	COcccccc6OC))))occc6=O))cccOCOc5cc9OC
Heavy Atom Count	26.0
Classyfire Class	Isoflavonoids
Scaffold Graph Node Level	OC1C(C2CCC3OCOC3C2)COC2CCCCC21
Classyfire Subclass	O-methylated isoflavonoids
Isotope Atom Count	0.0
Molecular Complexity	562.0
Database Name	cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Iupac Name	6,7-dimethoxy-3-(6-methoxy-1,3-benzodioxol-5-yl)chromen-4-one
Prediction Hob	1.0
Veber Rule	True
Classyfire Superclass	Phenylpropanoids and polyketides
Xlogp	2.9
Gsk 4 400 Rule	True
Molecular Formula	C19H16O7
Scaffold Graph Node Bond Level	O=c1c(-c2ccc3c(c2)OCO3)coc2ccccc12
Prediction Swissadme	0.0
Inchi Key	INHRJYBOMHQVBR-UHFFFAOYSA-N
Silicos It Class	Poorly soluble
Fcsp3	0.2105263157894736
Logs	-5.265
Rotatable Bond Count	4.0
Logd	2.903
Synonyms	milldurone
Esol Class	Moderately soluble
Functional Groups	c1cOCO1, c=O, cOC, coc
Compound Name	Milldurone
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	-3.5762306153846164
Inchi	InChI=1S/C19H16O7/c1-21-13-6-18-17(25-9-26-18)4-10(13)12-8-24-14-7-16(23-3)15(22-2)5-11(14)19(12)20/h4-8H,9H2,1-3H3
Smiles	COC1=CC2=C(C=C1C3=COC4=CC(=C(C=C4C3=O)OC)OC)OCO2
Nring	4.0
Np Classifier Biosynthetic Pathway	Shikimates and Phenylpropanoids
Defined Bond Stereocenter Count	0.0
Egan Rule	True
Np Classifier Superclass	Isoflavonoids

1. Outgoing r'ship FOUND_IN to/from Abies Excelsa (Plant) Rel Props:Reference:
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8. Outgoing r'ship FOUND_IN to/from Aeollanthus Pubescens (Plant) Rel Props:Reference:
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16. Outgoing r'ship FOUND_IN to/from Angelica Pubescens (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Arctostaphylos Pumila (Plant) Rel Props:Source_db:npass_chem_all
18. Outgoing r'ship FOUND_IN to/from Ardisia Macrocarpa (Plant) Rel Props:Reference:
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53. Outgoing r'ship FOUND_IN to/from Cinnamosma Macrocarpa (Plant) Rel Props:Reference:
54. Outgoing r'ship FOUND_IN to/from Combretum Yunnanensis (Plant) Rel Props:Reference:
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57. Outgoing r'ship FOUND_IN to/from Cupressus Macrocarpa (Plant) Rel Props:Reference:
58. Outgoing r'ship FOUND_IN to/from Dalbergia Lanceolaria (Plant) Rel Props:Reference:ISBN:9770972795006; ISBN:9788172360481; ISBN:9788185042084
59. Outgoing r'ship FOUND_IN to/from Didymocarpus Aurantiacus (Plant) Rel Props:Reference:
60. Outgoing r'ship FOUND_IN to/from Diplacus Aurantiacus (Plant) Rel Props:Reference:
61. Outgoing r'ship FOUND_IN to/from Ehretia Pubescens (Plant) Rel Props:Reference:
62. Outgoing r'ship FOUND_IN to/from Epimedium Pubescens (Plant) Rel Props:Reference:
63. Outgoing r'ship FOUND_IN to/from Erythrina Abyssinica (Plant) Rel Props:Reference:
64. Outgoing r'ship FOUND_IN to/from Erythrina Americana (Plant) Rel Props:Reference:
65. Outgoing r'ship FOUND_IN to/from Erythrina Arborescens (Plant) Rel Props:Reference:
66. Outgoing r'ship FOUND_IN to/from Erythrina Berteroana (Plant) Rel Props:Reference:
67. Outgoing r'ship FOUND_IN to/from Erythrina Burttii (Plant) Rel Props:Reference:
68. Outgoing r'ship FOUND_IN to/from Erythrina Chiriquensis (Plant) Rel Props:Reference:
69. Outgoing r'ship FOUND_IN to/from Erythrina Folkersii (Plant) Rel Props:Reference:
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75. Outgoing r'ship FOUND_IN to/from Erythrina Lysistemon (Plant) Rel Props:Reference:
76. Outgoing r'ship FOUND_IN to/from Erythrina Melanacantha (Plant) Rel Props:Reference:
77. Outgoing r'ship FOUND_IN to/from Erythrina Orientalis (Plant) Rel Props:Reference:
78. Outgoing r'ship FOUND_IN to/from Erythrina Pallida (Plant) Rel Props:Reference:
79. Outgoing r'ship FOUND_IN to/from Erythrina Poeppigiana (Plant) Rel Props:Reference:
80. Outgoing r'ship FOUND_IN to/from Erythrina Resupinata (Plant) Rel Props:Reference:
81. Outgoing r'ship FOUND_IN to/from Erythrina Sacleuxii (Plant) Rel Props:Reference:
82. Outgoing r'ship FOUND_IN to/from Erythrina Salviiflora (Plant) Rel Props:Reference:
83. Outgoing r'ship FOUND_IN to/from Erythrina Sandwicensis (Plant) Rel Props:Reference:
84. Outgoing r'ship FOUND_IN to/from Erythrina Senegalensis (Plant) Rel Props:Reference:
85. Outgoing r'ship FOUND_IN to/from Erythrina Sigmoidea (Plant) Rel Props:Reference:
86. Outgoing r'ship FOUND_IN to/from Erythrina Speciosa (Plant) Rel Props:Reference:
87. Outgoing r'ship FOUND_IN to/from Erythrina Stricta (Plant) Rel Props:Reference:
88. Outgoing r'ship FOUND_IN to/from Erythrina Suberosa (Plant) Rel Props:Reference:
89. Outgoing r'ship FOUND_IN to/from Erythrina Subumbrans (Plant) Rel Props:Reference:
90. Outgoing r'ship FOUND_IN to/from Erythrina Variegata (Plant) Rel Props:Reference:
91. Outgoing r'ship FOUND_IN to/from Erythrina Variegate (Plant) Rel Props:Reference:
92. Outgoing r'ship FOUND_IN to/from Erythrina Vogelii (Plant) Rel Props:Reference:
93. Outgoing r'ship FOUND_IN to/from Eucalyptus Alata (Plant) Rel Props:Reference:
94. Outgoing r'ship FOUND_IN to/from Eucalyptus Alba (Plant) Rel Props:Reference:
95. Outgoing r'ship FOUND_IN to/from Eucalyptus Albens (Plant) Rel Props:Reference:
96. Outgoing r'ship FOUND_IN to/from Eucalyptus Amplifolia (Plant) Rel Props:Reference:
97. Outgoing r'ship FOUND_IN to/from Eucalyptus Apodophylla (Plant) Rel Props:Reference:
98. Outgoing r'ship FOUND_IN to/from Eucalyptus Astringens (Plant) Rel Props:Reference:
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100. Outgoing r'ship FOUND_IN to/from Eucalyptus Baueriana (Plant) Rel Props:Reference:
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130. Outgoing r'ship FOUND_IN to/from Eucalyptus Kirtoniana (Plant) Rel Props:Reference:
131. Outgoing r'ship FOUND_IN to/from Eucalyptus Kitsoni (Plant) Rel Props:Reference:
132. Outgoing r'ship FOUND_IN to/from Eucalyptus Kitsoniana (Plant) Rel Props:Reference:
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139. Outgoing r'ship FOUND_IN to/from Eucalyptus Maideni (Plant) Rel Props:Reference:
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142. Outgoing r'ship FOUND_IN to/from Eucalyptus Michaeliana (Plant) Rel Props:Reference:
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181. Outgoing r'ship FOUND_IN to/from Helianthus Annuus (Plant) Rel Props:Reference:
182. Outgoing r'ship FOUND_IN to/from Helianthus Californicus (Plant) Rel Props:Reference:
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188. Outgoing r'ship FOUND_IN to/from Helianthus Niveus (Plant) Rel Props:Reference:
189. Outgoing r'ship FOUND_IN to/from Helianthus Pumilus (Plant) Rel Props:Reference:
190. Outgoing r'ship FOUND_IN to/from Helianthus Strumosus (Plant) Rel Props:Reference:
191. Outgoing r'ship FOUND_IN to/from Helianthus Tuberosus (Plant) Rel Props:Reference:
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193. Outgoing r'ship FOUND_IN to/from Hesperocyparis Macrocarpa (Plant) Rel Props:Reference:
194. Outgoing r'ship FOUND_IN to/from Hibiscus Abelmoschus (Plant) Rel Props:Reference:
195. Outgoing r'ship FOUND_IN to/from Hibiscus Aculeatus (Plant) Rel Props:Reference:
196. Outgoing r'ship FOUND_IN to/from Hibiscus Cancellatus (Plant) Rel Props:Reference:
197. Outgoing r'ship FOUND_IN to/from Hibiscus Canescens (Plant) Rel Props:Reference:
198. Outgoing r'ship FOUND_IN to/from Hibiscus Cannabinus (Plant) Rel Props:Reference:
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200. Outgoing r'ship FOUND_IN to/from Hibiscus Ficulneus (Plant) Rel Props:Reference:
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202. Outgoing r'ship FOUND_IN to/from Hibiscus Hirtus (Plant) Rel Props:Reference:
203. Outgoing r'ship FOUND_IN to/from Hibiscus Hispidissimus (Plant) Rel Props:Reference:
204. Outgoing r'ship FOUND_IN to/from Hibiscus Lampas (Plant) Rel Props:Reference:
205. Outgoing r'ship FOUND_IN to/from Hibiscus Lunariifolius (Plant) Rel Props:Reference:
206. Outgoing r'ship FOUND_IN to/from Hibiscus Manihot (Plant) Rel Props:Reference:
207. Outgoing r'ship FOUND_IN to/from Hibiscus Micranthus (Plant) Rel Props:Reference:
208. Outgoing r'ship FOUND_IN to/from Hibiscus Mutabilis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
209. Outgoing r'ship FOUND_IN to/from Hibiscus Ovalifolius (Plant) Rel Props:Reference:
210. Outgoing r'ship FOUND_IN to/from Hibiscus Pas (Plant) Rel Props:Reference:
211. Outgoing r'ship FOUND_IN to/from Hibiscus Platanifolius (Plant) Rel Props:Reference:
212. Outgoing r'ship FOUND_IN to/from Hibiscus Populneus (Plant) Rel Props:Reference:
213. Outgoing r'ship FOUND_IN to/from Hibiscus Rosasinensis (Plant) Rel Props:Reference:
214. Outgoing r'ship FOUND_IN to/from Hibiscus Sabdariffa (Plant) Rel Props:Reference:
215. Outgoing r'ship FOUND_IN to/from Hibiscus Schizopetalus (Plant) Rel Props:Reference:
216. Outgoing r'ship FOUND_IN to/from Hibiscus Surattensis (Plant) Rel Props:Reference:
217. Outgoing r'ship FOUND_IN to/from Hibiscus Syriacus (Plant) Rel Props:Reference:
218. Outgoing r'ship FOUND_IN to/from Hibiscus Taiwanensis (Plant) Rel Props:Reference:
219. Outgoing r'ship FOUND_IN to/from Hibiscus Tiliaceus (Plant) Rel Props:Reference:
220. Outgoing r'ship FOUND_IN to/from Hibiscus Tilliaceus (Plant) Rel Props:Reference:
221. Outgoing r'ship FOUND_IN to/from Hibiscus Trionum (Plant) Rel Props:Reference:
222. Outgoing r'ship FOUND_IN to/from Hibiscus Vitifolius (Plant) Rel Props:Reference:
223. Outgoing r'ship FOUND_IN to/from Hippocratea Excelsa (Plant) Rel Props:Reference:
224. Outgoing r'ship FOUND_IN to/from Hodgsonia Macrocarpa (Plant) Rel Props:Reference:
225. Outgoing r'ship FOUND_IN to/from Holarrhena Pubescens (Plant) Rel Props:Reference:
226. Outgoing r'ship FOUND_IN to/from Hydnocarpus Macrocarpa (Plant) Rel Props:Reference:
227. Outgoing r'ship FOUND_IN to/from Hypoestes Rosea (Plant) Rel Props:Reference:
228. Outgoing r'ship FOUND_IN to/from Ilex Excelsa (Plant) Rel Props:Reference:
229. Outgoing r'ship FOUND_IN to/from Ilex Pubescens (Plant) Rel Props:Reference:
230. Outgoing r'ship FOUND_IN to/from Indigofera Aspalathoides (Plant) Rel Props:Reference:
231. Outgoing r'ship FOUND_IN to/from Inga Velutina (Plant) Rel Props:Reference:
232. Outgoing r'ship FOUND_IN to/from Juniperus Excelsa (Plant) Rel Props:Reference:
233. Outgoing r'ship FOUND_IN to/from Kallstroemia Pubescens (Plant) Rel Props:Reference:
234. Outgoing r'ship FOUND_IN to/from Knightia Excelsa (Plant) Rel Props:Reference:
235. Outgoing r'ship FOUND_IN to/from Kniphofia Pumila (Plant) Rel Props:Reference:
236. Outgoing r'ship FOUND_IN to/from Lochnera Rosea (Plant) Rel Props:Reference:
237. Outgoing r'ship FOUND_IN to/from Lupinus Mutabilis (Plant) Rel Props:Reference:
238. Outgoing r'ship FOUND_IN to/from Magnolia Mutabilis (Plant) Rel Props:Reference:
239. Outgoing r'ship FOUND_IN to/from Malus Pumila (Plant) Rel Props:Reference:
240. Outgoing r'ship FOUND_IN to/from Metzgeria Pubescens (Plant) Rel Props:Reference:
241. Outgoing r'ship FOUND_IN to/from Michelia Yunnanensis (Plant) Rel Props:Reference:
242. Outgoing r'ship FOUND_IN to/from Micromelum Pubescens (Plant) Rel Props:Reference:
243. Outgoing r'ship FOUND_IN to/from Milicia Excelsa (Plant) Rel Props:Reference:
244. Outgoing r'ship FOUND_IN to/from Miliusa Velutina (Plant) Rel Props:Reference:
245. Outgoing r'ship FOUND_IN to/from Morinda Pubescens (Plant) Rel Props:Reference:
246. Outgoing r'ship FOUND_IN to/from Morus Yunnanensis (Plant) Rel Props:Reference:
247. Outgoing r'ship FOUND_IN to/from Mussaenda Pubescens (Plant) Rel Props:Reference:
248. Outgoing r'ship FOUND_IN to/from Nymphaea Pubescens (Plant) Rel Props:Reference:
249. Outgoing r'ship FOUND_IN to/from Ochna Pumila (Plant) Rel Props:Reference:
250. Outgoing r'ship FOUND_IN to/from Ophiorrhiza Pumila (Plant) Rel Props:Reference:
251. Outgoing r'ship FOUND_IN to/from Otholobium Pubescens (Plant) Rel Props:Reference:
252. Outgoing r'ship FOUND_IN to/from Palafoxia Rosea (Plant) Rel Props:Reference:
253. Outgoing r'ship FOUND_IN to/from Peltogyne Pubescens (Plant) Rel Props:Reference:
254. Outgoing r'ship FOUND_IN to/from Pentachondra Pumila (Plant) Rel Props:Reference:
255. Outgoing r'ship FOUND_IN to/from Phaleria Macrocarpa (Plant) Rel Props:Reference:
256. Outgoing r'ship FOUND_IN to/from Phlegmariurus Yunnanensis (Plant) Rel Props:Reference:
257. Outgoing r'ship FOUND_IN to/from Pholidota Yunnanensis (Plant) Rel Props:Reference:
258. Outgoing r'ship FOUND_IN to/from Physalis Pubescens (Plant) Rel Props:Reference:
259. Outgoing r'ship FOUND_IN to/from Picrasma Excelsa (Plant) Rel Props:Reference:
260. Outgoing r'ship FOUND_IN to/from Pinus Excelsa (Plant) Rel Props:Reference:
261. Outgoing r'ship FOUND_IN to/from Pinus Pumila (Plant) Rel Props:Reference:
262. Outgoing r'ship FOUND_IN to/from Pinus Yunnanensis (Plant) Rel Props:Reference:
263. Outgoing r'ship FOUND_IN to/from Piptanthus Nanus (Plant) Rel Props:Reference:
264. Outgoing r'ship FOUND_IN to/from Pleione Yunnanensis (Plant) Rel Props:Reference:
265. Outgoing r'ship FOUND_IN to/from Pleopeltis Macrocarpa (Plant) Rel Props:Reference:
266. Outgoing r'ship FOUND_IN to/from Plumbago Rosea (Plant) Rel Props:Reference:
267. Outgoing r'ship FOUND_IN to/from Pogostemon Pubescens (Plant) Rel Props:Reference:
268. Outgoing r'ship FOUND_IN to/from Populus Yunnanensis (Plant) Rel Props:Reference:
269. Outgoing r'ship FOUND_IN to/from Primula Rosea (Plant) Rel Props:Reference:
270. Outgoing r'ship FOUND_IN to/from Pterodon Emarginatus (Plant) Rel Props:Reference:
271. Outgoing r'ship FOUND_IN to/from Rauvolfia Yunnanensis (Plant) Rel Props:Reference:
272. Outgoing r'ship FOUND_IN to/from Relhania Pumila (Plant) Rel Props:Reference:
273. Outgoing r'ship FOUND_IN to/from Rhodiola Rosea (Plant) Rel Props:Reference:
274. Outgoing r'ship FOUND_IN to/from Rhodomyrtus Macrocarpa (Plant) Rel Props:Reference:
275. Outgoing r'ship FOUND_IN to/from Rubia Yunnanensis (Plant) Rel Props:Reference:
276. Outgoing r'ship FOUND_IN to/from Ruellia Rosea (Plant) Rel Props:Reference:
277. Outgoing r'ship FOUND_IN to/from Salvia Yunnanensis (Plant) Rel Props:Reference:
278. Outgoing r'ship FOUND_IN to/from Setaria Pumila (Plant) Rel Props:Reference:
279. Outgoing r'ship FOUND_IN to/from Siegesbeckia Orientalis (Plant) Rel Props:Reference:
280. Outgoing r'ship FOUND_IN to/from Sigesbeckia Pubescens (Plant) Rel Props:Reference:
281. Outgoing r'ship FOUND_IN to/from Sinodielsia Yunnanensis (Plant) Rel Props:Reference:
282. Outgoing r'ship FOUND_IN to/from Solanum Pubescens (Plant) Rel Props:Reference:
283. Outgoing r'ship FOUND_IN to/from Sophora Velutina (Plant) Rel Props:Reference:
284. Outgoing r'ship FOUND_IN to/from Stachytarpheta Mutabilis (Plant) Rel Props:Reference:
285. Outgoing r'ship FOUND_IN to/from Swertia Pubescens (Plant) Rel Props:Reference:
286. Outgoing r'ship FOUND_IN to/from Syringa Pubescens (Plant) Rel Props:Reference:
287. Outgoing r'ship FOUND_IN to/from Tabebuia Rosea (Plant) Rel Props:Reference:
288. Outgoing r'ship FOUND_IN to/from Tabernaemontana Calcarea (Plant) Rel Props:Reference:
289. Outgoing r'ship FOUND_IN to/from Tephrosia Pumila (Plant) Rel Props:Reference:
290. Outgoing r'ship FOUND_IN to/from Torreya Fargesii (Plant) Rel Props:Reference:
291. Outgoing r'ship FOUND_IN to/from Torreya Yunnanensis (Plant) Rel Props:Reference:
292. Outgoing r'ship FOUND_IN to/from Ulex Airensis (Plant) Rel Props:Reference:
293. Outgoing r'ship FOUND_IN to/from Ulex Europaeus (Plant) Rel Props:Reference:
294. Outgoing r'ship FOUND_IN to/from Ulex Minor (Plant) Rel Props:Reference:
295. Outgoing r'ship FOUND_IN to/from Ulex Nanus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
296. Outgoing r'ship FOUND_IN to/from Ulmus Americana (Plant) Rel Props:Reference:
297. Outgoing r'ship FOUND_IN to/from Ulmus Glabra (Plant) Rel Props:Reference:
298. Outgoing r'ship FOUND_IN to/from Ulmus Laciniata (Plant) Rel Props:Reference:
299. Outgoing r'ship FOUND_IN to/from Ulmus Parvifolia (Plant) Rel Props:Reference:
300. Outgoing r'ship FOUND_IN to/from Ulmus Pumila (Plant) Rel Props:Reference:
301. Outgoing r'ship FOUND_IN to/from Ulmus Wallichiana (Plant) Rel Props:Reference:
302. Outgoing r'ship FOUND_IN to/from Vasconcellea Pubescens (Plant) Rel Props:Reference:
303. Outgoing r'ship FOUND_IN to/from Vateria Macrocarpa (Plant) Rel Props:Reference:
304. Outgoing r'ship FOUND_IN to/from Vinca Rosea (Plant) Rel Props:Reference:
305. Outgoing r'ship FOUND_IN to/from Walsura Yunnanensis (Plant) Rel Props:Reference:
306. Outgoing r'ship FOUND_IN to/from Zamia Pumila (Plant) Rel Props:Reference:
307. Outgoing r'ship FOUND_IN to/from Zephyranthes Rosea (Plant) Rel Props:Reference:
308. Outgoing r'ship FOUND_IN to/from Zieria Chevalieri (Plant) Rel Props:Reference:
309. Outgoing r'ship FOUND_IN to/from Zieria Smithii (Plant) Rel Props:Reference:

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Phytochemical Properties

Associated Connections 309

Plant Connections 309