Fulvoplumierin

PubChem CID: 5281541

Connections displayed (default: 10).

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Compound Synonyms	Fulvoplumierin, 20867-01-0, Plumiera rubra, CHEBI:5188, NSC609064, NSC661970, 88W5O194BU, NSC-609064, NSC-661970, methyl (7E)-7-[(E)-but-2-enylidene]-1-oxo-cyclopenta[c]pyran-4-carboxylate, Cyclopenta(c)pyran-4-carboxylic acid, 7-(2-butenylidene)-1,7-dihydro-1-oxo-, methyl ester, (E,E)-, Cyclopenta[c]pyran-4-carboxylic acid,7-dihydro-1-oxo-, methyl ester, (E,E)-, (E,E)-7-(2-BUTENYLIDENE)-1,7-DIHYDRO-1-OXOCYCLOPENTA(C)PYRAN-4-CARBOXYLIC ACID METHYL ESTER, (E,E)-7-(2-Butenylidene)-1,7-dihydro-1-oxocyclopenta[c]pyran-4-carboxylic acid methyl ester, FULVOPLUMIERIN [MI], methyl (7E)-7-[(E)-but-2-enylidene]-1-oxocyclopenta[c]pyran-4-carboxylate, SCHEMBL436269, UNII-88W5O194BU, CHEMBL445545, DTXSID101126054, BDBM50480323, NSC 609064, NSC 661970, C09778, Q27106683, METHYL 7-CROTONYLIDENECYCLOPENTA(C)PYRAN-1(7H)-ONE-4-CARBOXYLATE, METHYL 7-CROTONYLIDENECYCLOPENTA(C)PYRAN-1-(7H)-ONE-4-CARBOXYLATE, Methyl (7E)-7-(2E)-2-buten-1-ylidene-1,7-dihydro-1-oxocyclopenta[c]pyran-4-carboxylate, (7E)-7-(2E)-BUTEN-1-YLIDENE-1,7-DIHYDRO-1-OXOCYCLOPENTA(C)PYRAN-4-CARBOXYLIC ACID METHYL ESTER, (e,e)-7-(2-butenylidene)-1,7-dihydro-1-oxo-cyclopenta(c)pyran-4-carboxylic acid methyl ester, 3-(2-BUTENYLIDENE)-2-CARBOXY-.ALPHA.-(HYDROXYMETHYLENE)-1,4-CYCLOPENTADIENE-1-ACETIC ACID .DELTA.-LACTONE METHYL ESTER, CYCLOPENTA(C)PYRAN-4-CARBOXYLIC ACID, 7-(2E)-2-BUTENYLIDENE-1,7-DIHYDRO-1-OXO-, METHYL ESTER, (7E)-
Ghose Rule	True
Classyfire Kingdom	Organic compounds
Topological Polar Surface Area	52.6
Hydrogen Bond Donor Count	0.0
Pfizer 3 75 Rule	False
Scaffold Graph Level	CC1CCCC2CCC(C)C12
Np Classifier Class	Iridoids monoterpenoids
Deep Smiles	C/C=C/C=CC=Ccc5c=O)occ6C=O)OC
Heavy Atom Count	18.0
Classyfire Class	Pyrans
Scaffold Graph Node Level	CC1CCC2CCOC(O)C12
Classyfire Subclass	Pyranones and derivatives
Isotope Atom Count	0.0
Molecular Complexity	556.0
Database Name	cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Uniprot Id	n.a., Q72547, P18858
Iupac Name	methyl (7E)-7-[(E)-but-2-enylidene]-1-oxocyclopenta[c]pyran-4-carboxylate
Prediction Hob	1.0
Veber Rule	True
Classyfire Superclass	Organoheterocyclic compounds
Xlogp	1.7
Gsk 4 400 Rule	True
Molecular Formula	C14H12O4
Scaffold Graph Node Bond Level	C=C1C=Cc2ccoc(=O)c21
Prediction Swissadme	0.0
Inchi Key	RFUJEBHESHKXKW-PRKJJMSOSA-N
Silicos It Class	Soluble
Fcsp3	0.1428571428571428
Logs	-3.239
Rotatable Bond Count	3.0
Logd	1.414
Synonyms	fulvoplumierin, pigment 5'-carbomethoxy-3',4',1,2-cumalino-ω-propenylfulvene (fulvoplumierin)
Esol Class	Soluble
Functional Groups	C/C=C/C=C1C=Ccc1, c=O, cC(=O)OC, coc
Compound Name	Fulvoplumierin
Prediction Hob Swissadme	0.0
Exact Mass	244.074
Formal Charge	0.0
Monoisotopic Mass	244.074
Hydrogen Bond Acceptor Count	4.0
Molecular Weight	244.24
Gi Absorption	True
Covalent Unit Count	1.0
Total Atom Stereocenter Count	0.0
Total Bond Stereocenter Count	2.0
Lipinski Rule Of 5	True
Esol	-1.4407918666666661
Inchi	InChI=1S/C14H12O4/c1-3-4-5-9-6-7-10-11(13(15)17-2)8-18-14(16)12(9)10/h3-8H,1-2H3/b4-3+,9-5+
Smiles	C/C=C/C=C/1\C=CC2=C1C(=O)OC=C2C(=O)OC
Nring	2.0
Np Classifier Biosynthetic Pathway	Terpenoids
Defined Bond Stereocenter Count	2.0
Egan Rule	True
Np Classifier Superclass	Monoterpenoids

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80. Outgoing r'ship FOUND_IN to/from Agathis Lanceolata (Plant) Rel Props:Reference:
81. Outgoing r'ship FOUND_IN to/from Agave Angustifolia (Plant) Rel Props:Reference:
82. Outgoing r'ship FOUND_IN to/from Alstonia Angustifolia (Plant) Rel Props:Reference:
83. Outgoing r'ship FOUND_IN to/from Althaea Officinalis (Plant) Rel Props:Reference:
84. Outgoing r'ship FOUND_IN to/from Althea Officinalis (Plant) Rel Props:Reference:
85. Outgoing r'ship FOUND_IN to/from Anchusa Officinalis (Plant) Rel Props:Reference:
86. Outgoing r'ship FOUND_IN to/from Angelica Officinalis (Plant) Rel Props:Reference:
87. Outgoing r'ship FOUND_IN to/from Antiaris Welwitschii (Plant) Rel Props:Reference:
88. Outgoing r'ship FOUND_IN to/from Araucaria Angustifolia (Plant) Rel Props:Reference:
89. Outgoing r'ship FOUND_IN to/from Artemisia Mexicana (Plant) Rel Props:Reference:
90. Outgoing r'ship FOUND_IN to/from Asparagus Officinalis (Plant) Rel Props:Reference:
91. Outgoing r'ship FOUND_IN to/from Avcennia Officinalis (Plant) Rel Props:Reference:
92. Outgoing r'ship FOUND_IN to/from Avicennia Officinalis (Plant) Rel Props:Reference:
93. Outgoing r'ship FOUND_IN to/from Baccharis Angustifolia (Plant) Rel Props:Reference:
94. Outgoing r'ship FOUND_IN to/from Backhousia Angustifolia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
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200. Outgoing r'ship FOUND_IN to/from Juniperus Macropoda (Plant) Rel Props:Reference:
201. Outgoing r'ship FOUND_IN to/from Juniperus Occidentalis (Plant) Rel Props:Reference:
202. Outgoing r'ship FOUND_IN to/from Juniperus Oxycedrus (Plant) Rel Props:Reference:
203. Outgoing r'ship FOUND_IN to/from Juniperus Phoenicea (Plant) Rel Props:Reference:
204. Outgoing r'ship FOUND_IN to/from Juniperus Polycarpos (Plant) Rel Props:Reference:
205. Outgoing r'ship FOUND_IN to/from Juniperus Procera (Plant) Rel Props:Reference:
206. Outgoing r'ship FOUND_IN to/from Juniperus Pseudosabina (Plant) Rel Props:Reference:
207. Outgoing r'ship FOUND_IN to/from Juniperus Recurva (Plant) Rel Props:Reference:
208. Outgoing r'ship FOUND_IN to/from Juniperus Rigida (Plant) Rel Props:Reference:
209. Outgoing r'ship FOUND_IN to/from Juniperus Sabina (Plant) Rel Props:Reference:
210. Outgoing r'ship FOUND_IN to/from Juniperus Scopulorum (Plant) Rel Props:Reference:
211. Outgoing r'ship FOUND_IN to/from Juniperus Semiglobosa (Plant) Rel Props:Reference:
212. Outgoing r'ship FOUND_IN to/from Juniperus Serawschanica (Plant) Rel Props:Reference:
213. Outgoing r'ship FOUND_IN to/from Juniperus Silicicola (Plant) Rel Props:Reference:
214. Outgoing r'ship FOUND_IN to/from Juniperus Squamata (Plant) Rel Props:Reference:
215. Outgoing r'ship FOUND_IN to/from Juniperus Taiwaniana (Plant) Rel Props:Reference:
216. Outgoing r'ship FOUND_IN to/from Juniperus Thurifera (Plant) Rel Props:Reference:
217. Outgoing r'ship FOUND_IN to/from Juniperus Virginiana (Plant) Rel Props:Reference:
218. Outgoing r'ship FOUND_IN to/from Kadsura Angustifolia (Plant) Rel Props:Reference:
219. Outgoing r'ship FOUND_IN to/from Kaempferia Angustifolia (Plant) Rel Props:Reference:
220. Outgoing r'ship FOUND_IN to/from Kalanchoe Blossfeldiana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
221. Outgoing r'ship FOUND_IN to/from Kalanchoe Integra (Plant) Rel Props:Reference:
222. Outgoing r'ship FOUND_IN to/from Kalanchoe Laciniata (Plant) Rel Props:Reference:
223. Outgoing r'ship FOUND_IN to/from Kalanchoe Lanceolata (Plant) Rel Props:Reference:
224. Outgoing r'ship FOUND_IN to/from Kalanchoe Marmorata (Plant) Rel Props:Reference:
225. Outgoing r'ship FOUND_IN to/from Kalanchoe Pinnata (Plant) Rel Props:Reference:
226. Outgoing r'ship FOUND_IN to/from Kalanchoe Spathulata (Plant) Rel Props:Reference:
227. Outgoing r'ship FOUND_IN to/from Kopsia Officinalis (Plant) Rel Props:Reference:
228. Outgoing r'ship FOUND_IN to/from Lagerstroemia Lanceolata (Plant) Rel Props:Reference:
229. Outgoing r'ship FOUND_IN to/from Laggera Aurita (Plant) Rel Props:Reference:
230. Outgoing r'ship FOUND_IN to/from Laricifomes Officinalis (Plant) Rel Props:Reference:
231. Outgoing r'ship FOUND_IN to/from Lavandula Angustifolia (Plant) Rel Props:Reference:
232. Outgoing r'ship FOUND_IN to/from Lavandula Officinalis (Plant) Rel Props:Reference:
233. Outgoing r'ship FOUND_IN to/from Lonicera Angustifolia (Plant) Rel Props:Reference:
234. Outgoing r'ship FOUND_IN to/from Magnolia Officinalis (Plant) Rel Props:Reference:
235. Outgoing r'ship FOUND_IN to/from Mandragora Officinalis (Plant) Rel Props:Reference:
236. Outgoing r'ship FOUND_IN to/from Melilotus Officinalis (Plant) Rel Props:Reference:
237. Outgoing r'ship FOUND_IN to/from Meliosma Lanceolata (Plant) Rel Props:Reference:
238. Outgoing r'ship FOUND_IN to/from Melissa Officinalis (Plant) Rel Props:Reference:
239. Outgoing r'ship FOUND_IN to/from Meryta Lanceolata (Plant) Rel Props:Reference:
240. Outgoing r'ship FOUND_IN to/from Morella Rubra (Plant) Rel Props:Reference:
241. Outgoing r'ship FOUND_IN to/from Morinda Angustifolia (Plant) Rel Props:Reference:
242. Outgoing r'ship FOUND_IN to/from Morus Rubra (Plant) Rel Props:Reference:
243. Outgoing r'ship FOUND_IN to/from Myristica Officinalis (Plant) Rel Props:Reference:
244. Outgoing r'ship FOUND_IN to/from Nauclea Officinalis (Plant) Rel Props:Reference:
245. Outgoing r'ship FOUND_IN to/from Nectandra Rubra (Plant) Rel Props:Reference:
246. Outgoing r'ship FOUND_IN to/from Neolitsea Villosa (Plant) Rel Props:Reference:
247. Outgoing r'ship FOUND_IN to/from Nymphaea Rubra (Plant) Rel Props:Reference:
248. Outgoing r'ship FOUND_IN to/from Ochna Lanceolata (Plant) Rel Props:Reference:
249. Outgoing r'ship FOUND_IN to/from Odontites Rubra (Plant) Rel Props:Reference:
250. Outgoing r'ship FOUND_IN to/from Ophelia Angustifolia (Plant) Rel Props:Reference:
251. Outgoing r'ship FOUND_IN to/from Osyris Lanceolata (Plant) Rel Props:Reference:
252. Outgoing r'ship FOUND_IN to/from Paeonia Officinalis (Plant) Rel Props:Reference:
253. Outgoing r'ship FOUND_IN to/from Patrinia Villosa (Plant) Rel Props:Reference:
254. Outgoing r'ship FOUND_IN to/from Paullinia Cupana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
255. Outgoing r'ship FOUND_IN to/from Paullinia Pinnata (Plant) Rel Props:Reference:
256. Outgoing r'ship FOUND_IN to/from Pentas Lanceolata (Plant) Rel Props:Reference:
257. Outgoing r'ship FOUND_IN to/from Petasites Officinalis (Plant) Rel Props:Reference:
258. Outgoing r'ship FOUND_IN to/from Phoebe Lanceolata (Plant) Rel Props:Reference:
259. Outgoing r'ship FOUND_IN to/from Pimenta Officinalis (Plant) Rel Props:Reference:
260. Outgoing r'ship FOUND_IN to/from Plantago Lanceolata (Plant) Rel Props:Reference:
261. Outgoing r'ship FOUND_IN to/from Pluchea Lanceolata (Plant) Rel Props:Reference:
262. Outgoing r'ship FOUND_IN to/from Plumeria Acutifolia (Plant) Rel Props:Reference:
263. Outgoing r'ship FOUND_IN to/from Plumeria Alba (Plant) Rel Props:Reference:
264. Outgoing r'ship FOUND_IN to/from Plumeria Obtusa (Plant) Rel Props:Reference:
265. Outgoing r'ship FOUND_IN to/from Plumeria Rubra (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
266. Outgoing r'ship FOUND_IN to/from Plumieria Rubra (Plant) Rel Props:Reference:
267. Outgoing r'ship FOUND_IN to/from Populus Angustifolia (Plant) Rel Props:Reference:
268. Outgoing r'ship FOUND_IN to/from Pothos Officinalis (Plant) Rel Props:Reference:
269. Outgoing r'ship FOUND_IN to/from Prunus Salicina (Plant) Rel Props:Reference:
270. Outgoing r'ship FOUND_IN to/from Pterocarpus Officinalis (Plant) Rel Props:Reference:
271. Outgoing r'ship FOUND_IN to/from Pulicaria Angustifolia (Plant) Rel Props:Reference:
272. Outgoing r'ship FOUND_IN to/from Pyrrosia Lanceolata (Plant) Rel Props:Reference:
273. Outgoing r'ship FOUND_IN to/from Quercus Rubra (Plant) Rel Props:Reference:
274. Outgoing r'ship FOUND_IN to/from Quisqualis Indica (Plant) Rel Props:Reference:
275. Outgoing r'ship FOUND_IN to/from Rabdosia Angustifolia (Plant) Rel Props:Reference:
276. Outgoing r'ship FOUND_IN to/from Rhus Lanceolata (Plant) Rel Props:Reference:
277. Outgoing r'ship FOUND_IN to/from Rosa Rubra (Plant) Rel Props:Reference:
278. Outgoing r'ship FOUND_IN to/from Rosmarinus Officinalis (Plant) Rel Props:Reference:
279. Outgoing r'ship FOUND_IN to/from Ruta Angustifolia (Plant) Rel Props:Reference:
280. Outgoing r'ship FOUND_IN to/from Salvia Officinalis (Plant) Rel Props:Reference:
281. Outgoing r'ship FOUND_IN to/from Sanguisorba Officinalis (Plant) Rel Props:Reference:
282. Outgoing r'ship FOUND_IN to/from Saponaria Officinalis (Plant) Rel Props:Reference:
283. Outgoing r'ship FOUND_IN to/from Sassafras Albidum (Plant) Rel Props:Reference:
284. Outgoing r'ship FOUND_IN to/from Sassafras Officinalis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
285. Outgoing r'ship FOUND_IN to/from Sassafras Randainense (Plant) Rel Props:Reference:
286. Outgoing r'ship FOUND_IN to/from Sassafras Tzumu (Plant) Rel Props:Reference:
287. Outgoing r'ship FOUND_IN to/from Scindapsus Officinalis (Plant) Rel Props:Reference:
288. Outgoing r'ship FOUND_IN to/from Sextonia Rubra (Plant) Rel Props:Reference:
289. Outgoing r'ship FOUND_IN to/from Sophora Angustifolia (Plant) Rel Props:Reference:
290. Outgoing r'ship FOUND_IN to/from Spergularia Rubra (Plant) Rel Props:Reference:
291. Outgoing r'ship FOUND_IN to/from Sterculia Villosa (Plant) Rel Props:Reference:
292. Outgoing r'ship FOUND_IN to/from Styrax Officinalis (Plant) Rel Props:Reference:
293. Outgoing r'ship FOUND_IN to/from Suregada Angustifolia (Plant) Rel Props:Reference:
294. Outgoing r'ship FOUND_IN to/from Suregada Lanceolata (Plant) Rel Props:Reference:
295. Outgoing r'ship FOUND_IN to/from Swertia Angustifolia (Plant) Rel Props:Reference:
296. Outgoing r'ship FOUND_IN to/from Tanacetum Argenteum (Plant) Rel Props:Reference:
297. Outgoing r'ship FOUND_IN to/from Tanacetum Balsamitoides (Plant) Rel Props:Reference:
298. Outgoing r'ship FOUND_IN to/from Tanacetum Cinerariifolium (Plant) Rel Props:Reference:
299. Outgoing r'ship FOUND_IN to/from Tanacetum Coccineum (Plant) Rel Props:Reference:
300. Outgoing r'ship FOUND_IN to/from Tanacetum Dolichophyllum (Plant) Rel Props:Reference:
301. Outgoing r'ship FOUND_IN to/from Tanacetum Gracile (Plant) Rel Props:Reference:
302. Outgoing r'ship FOUND_IN to/from Tanacetum Himachalensis (Plant) Rel Props:Reference:
303. Outgoing r'ship FOUND_IN to/from Tanacetum Microphyllum (Plant) Rel Props:Reference:
304. Outgoing r'ship FOUND_IN to/from Tanacetum Nanam (Plant) Rel Props:Reference:
305. Outgoing r'ship FOUND_IN to/from Tanacetum Nubigenum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
306. Outgoing r'ship FOUND_IN to/from Tanacetum Parthenifolium (Plant) Rel Props:Reference:
307. Outgoing r'ship FOUND_IN to/from Tanacetum Parthenium (Plant) Rel Props:Reference:
308. Outgoing r'ship FOUND_IN to/from Tanacetum Praeteritum (Plant) Rel Props:Reference:
309. Outgoing r'ship FOUND_IN to/from Tanacetum Santolina (Plant) Rel Props:Reference:
310. Outgoing r'ship FOUND_IN to/from Tanacetum Santolinoides (Plant) Rel Props:Reference:
311. Outgoing r'ship FOUND_IN to/from Tanacetum Sibiricum (Plant) Rel Props:Reference:
312. Outgoing r'ship FOUND_IN to/from Tanacetum Vulgare (Plant) Rel Props:Reference:
313. Outgoing r'ship FOUND_IN to/from Tasmannia Lanceolata (Plant) Rel Props:Reference:
314. Outgoing r'ship FOUND_IN to/from Tephrosia Villosa (Plant) Rel Props:Reference:
315. Outgoing r'ship FOUND_IN to/from Thermopsis Lanceolata (Plant) Rel Props:Reference:
316. Outgoing r'ship FOUND_IN to/from Tricholepis Angustifolia (Plant) Rel Props:Reference:
317. Outgoing r'ship FOUND_IN to/from Turnera Angustifolia (Plant) Rel Props:Reference:
318. Outgoing r'ship FOUND_IN to/from Typha Angustifolia (Plant) Rel Props:Reference:
319. Outgoing r'ship FOUND_IN to/from Vaccinium Ashei (Plant) Rel Props:Reference:
320. Outgoing r'ship FOUND_IN to/from Valeriana Officinalis (Plant) Rel Props:Reference:
321. Outgoing r'ship FOUND_IN to/from Verbena Officinalis (Plant) Rel Props:Reference:
322. Outgoing r'ship FOUND_IN to/from Vernonia Lilacina (Plant) Rel Props:Reference:
323. Outgoing r'ship FOUND_IN to/from Vicia Villosa (Plant) Rel Props:Reference:
324. Outgoing r'ship FOUND_IN to/from Wikstroemia Lanceolata (Plant) Rel Props:Reference:
325. Outgoing r'ship FOUND_IN to/from Zamia Angustifolia (Plant) Rel Props:Reference:

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Associated Connections 325

Plant Connections 325