Powelline

PubChem CID: 443669

Connections displayed (default: 10).

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Compound Synonyms	Powelline, Powellin, 7363-25-9, Crinan-3-ol, 1,2-didehydro-7-methoxy-, (3alpha)-, (1S,13R,15R)-9-methoxy-5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9,16-tetraen-15-ol, 1,2-Didehydro-7-methoxycrinan-3arpha-ol, C12163, AC1L9EYZ, (1S,13R,15R)-9-methoxy-5,7-dioxa-12-azapentacyclo(10.5.2.01,13.02,10.04,8)nonadeca-2,4(8),9,16-tetraen-15-ol, 7-Methoxy-1,2-didehydrocrinan-3-ol, (3.alpha.)-, DTXSID60994431, 7-Methoxy-1,2-didehydrocrinan-3-ol, AKOS040734440, 7-Methoxy-1,2-didehydrocrinan-3-ol, (3alpha)-
Ghose Rule	True
Classyfire Kingdom	Organic compounds
Topological Polar Surface Area	51.2
Hydrogen Bond Donor Count	1.0
Pfizer 3 75 Rule	False
Scaffold Graph Level	C1CC2CC3CC4CCC5(CCCCC45)C3CC2C1
Np Classifier Class	Amarylidaceae alkaloids, Isoquinoline alkaloids
Deep Smiles	COccCNCC[C@]c7ccc%11OCO5)))))))[C@H]5C[C@H]C=C6))O
Heavy Atom Count	22.0
Classyfire Class	Amaryllidaceae alkaloids
Scaffold Graph Node Level	C1CCC23CCN(CC4CC5OCOC5CC42)C3C1
Classyfire Subclass	Crinine- and haemanthamine-type amaryllidaceae alkaloids
Isotope Atom Count	0.0
Molecular Complexity	497.0
Database Name	cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count	3.0
Iupac Name	(1S,13R,15R)-9-methoxy-5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9,16-tetraen-15-ol
Prediction Hob	1.0
Veber Rule	True
Classyfire Superclass	Alkaloids and derivatives
Xlogp	1.7
Gsk 4 400 Rule	True
Molecular Formula	C17H19NO4
Scaffold Graph Node Bond Level	C1=CC23CCN(Cc4cc5c(cc42)OCO5)C3CC1
Prediction Swissadme	1.0
Inchi Key	VXTCKUJRGBGTEH-NCAQKEMTSA-N
Silicos It Class	Soluble
Fcsp3	0.5294117647058824
Logs	-1.965
Rotatable Bond Count	1.0
Logd	0.931
Synonyms	powelline
Esol Class	Soluble
Functional Groups	CC=CC, CN(C)C, CO, c1cOCO1, cOC
Compound Name	Powelline
Prediction Hob Swissadme	1.0
Exact Mass	301.131
Formal Charge	0.0
Monoisotopic Mass	301.131
Hydrogen Bond Acceptor Count	5.0
Molecular Weight	301.34
Gi Absorption	True
Covalent Unit Count	1.0
Total Atom Stereocenter Count	3.0
Total Bond Stereocenter Count	0.0
Lipinski Rule Of 5	True
Esol	-2.9087881818181827
Inchi	InChI=1S/C17H19NO4/c1-20-15-11-8-18-5-4-17(3-2-10(19)6-14(17)18)12(11)7-13-16(15)22-9-21-13/h2-3,7,10,14,19H,4-6,8-9H2,1H3/t10-,14+,17+/m0/s1
Smiles	COC1=C2CN3CC[C@@]4([C@H]3C[C@H](C=C4)O)C2=CC5=C1OCO5
Nring	5.0
Np Classifier Biosynthetic Pathway	Alkaloids
Defined Bond Stereocenter Count	0.0
Egan Rule	True
Np Classifier Superclass	Tyrosine alkaloids

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109. Outgoing r'ship FOUND_IN to/from Crinum Bulbispermum (Plant) Rel Props:Reference:ISBN:9788172362133
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207. Outgoing r'ship FOUND_IN to/from Eupatorium Odenophorum (Plant) Rel Props:Reference:
208. Outgoing r'ship FOUND_IN to/from Eupatorium Odoratum (Plant) Rel Props:Reference:
209. Outgoing r'ship FOUND_IN to/from Eupatorium Petiolare (Plant) Rel Props:Reference:
210. Outgoing r'ship FOUND_IN to/from Eupatorium Rebaudianum (Plant) Rel Props:Reference:
211. Outgoing r'ship FOUND_IN to/from Eupatorium Recurvans (Plant) Rel Props:Reference:
212. Outgoing r'ship FOUND_IN to/from Eupatorium Riparium (Plant) Rel Props:Reference:
213. Outgoing r'ship FOUND_IN to/from Eupatorium Rotundifolium (Plant) Rel Props:Reference:
214. Outgoing r'ship FOUND_IN to/from Eupatorium Sachalinense (Plant) Rel Props:Reference:
215. Outgoing r'ship FOUND_IN to/from Eupatorium Semiserratum (Plant) Rel Props:Reference:
216. Outgoing r'ship FOUND_IN to/from Eupatorium Sternbergianum (Plant) Rel Props:Reference:
217. Outgoing r'ship FOUND_IN to/from Eupatorium Subhastatum (Plant) Rel Props:Reference:
218. Outgoing r'ship FOUND_IN to/from Eupatorium Urticaefolium (Plant) Rel Props:Reference:
219. Outgoing r'ship FOUND_IN to/from Garcinia Parvifolia (Plant) Rel Props:Reference:
220. Outgoing r'ship FOUND_IN to/from Gynochthodes Parvifolia (Plant) Rel Props:Reference:
221. Outgoing r'ship FOUND_IN to/from Haplopappus Ciliatus (Plant) Rel Props:Reference:
222. Outgoing r'ship FOUND_IN to/from Haplopappus Deserticola (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
223. Outgoing r'ship FOUND_IN to/from Haplopappus Venetus (Plant) Rel Props:Reference:
224. Outgoing r'ship FOUND_IN to/from Heracleum Lanatum (Plant) Rel Props:Reference:
225. Outgoing r'ship FOUND_IN to/from Hesperocyparis Arizonica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
226. Outgoing r'ship FOUND_IN to/from Hesperocyparis Goveniana (Plant) Rel Props:Reference:
227. Outgoing r'ship FOUND_IN to/from Hesperocyparis Macrocarpa (Plant) Rel Props:Reference:
228. Outgoing r'ship FOUND_IN to/from Hesperocyparis Nevadensis (Plant) Rel Props:Reference:
229. Outgoing r'ship FOUND_IN to/from Karwinskia Parvifolia (Plant) Rel Props:Reference:
230. Outgoing r'ship FOUND_IN to/from Krameria Parvifolia (Plant) Rel Props:Reference:
231. Outgoing r'ship FOUND_IN to/from Ladeania Juncea (Plant) Rel Props:Reference:
232. Outgoing r'ship FOUND_IN to/from Laggera Crispata (Plant) Rel Props:Reference:
233. Outgoing r'ship FOUND_IN to/from Lantana Aculeata (Plant) Rel Props:Reference:
234. Outgoing r'ship FOUND_IN to/from Lantana Camara (Plant) Rel Props:Reference:
235. Outgoing r'ship FOUND_IN to/from Lantana Indica (Plant) Rel Props:Reference:
236. Outgoing r'ship FOUND_IN to/from Lantana Montevidensis (Plant) Rel Props:Reference:
237. Outgoing r'ship FOUND_IN to/from Lespedeza Juncea (Plant) Rel Props:Reference:
238. Outgoing r'ship FOUND_IN to/from Mitragyna Parvifolia (Plant) Rel Props:Reference:
239. Outgoing r'ship FOUND_IN to/from Narthecium Asiaticum (Plant) Rel Props:Reference:
240. Outgoing r'ship FOUND_IN to/from Sinapis Juncea (Plant) Rel Props:Reference:
241. Outgoing r'ship FOUND_IN to/from Teucrium Asiaticum (Plant) Rel Props:Reference:
242. Outgoing r'ship FOUND_IN to/from Thalictrum Atriplex (Plant) Rel Props:Reference:
243. Outgoing r'ship FOUND_IN to/from Trachelospermum Asiaticum (Plant) Rel Props:Reference:
244. Outgoing r'ship FOUND_IN to/from Turraea Parvifolia (Plant) Rel Props:Reference:
245. Outgoing r'ship FOUND_IN to/from Ulmus Parvifolia (Plant) Rel Props:Reference:
246. Outgoing r'ship FOUND_IN to/from Viburnum Acuminatum (Plant) Rel Props:Reference:
247. Outgoing r'ship FOUND_IN to/from Viburnum Awabuki (Plant) Rel Props:Reference:
248. Outgoing r'ship FOUND_IN to/from Viburnum Ayavacense (Plant) Rel Props:Reference:
249. Outgoing r'ship FOUND_IN to/from Viburnum Betulifolium (Plant) Rel Props:Reference:
250. Outgoing r'ship FOUND_IN to/from Viburnum Chingii (Plant) Rel Props:Reference:
251. Outgoing r'ship FOUND_IN to/from Viburnum Colebrookianum (Plant) Rel Props:Reference:
252. Outgoing r'ship FOUND_IN to/from Viburnum Coriaceum (Plant) Rel Props:Reference:
253. Outgoing r'ship FOUND_IN to/from Viburnum Cotinifolium (Plant) Rel Props:Reference:
254. Outgoing r'ship FOUND_IN to/from Viburnum Cylindricum (Plant) Rel Props:Reference:
255. Outgoing r'ship FOUND_IN to/from Viburnum Davidii (Plant) Rel Props:Reference:
256. Outgoing r'ship FOUND_IN to/from Viburnum Dilatatum (Plant) Rel Props:Reference:
257. Outgoing r'ship FOUND_IN to/from Viburnum Erubescens (Plant) Rel Props:Reference:
258. Outgoing r'ship FOUND_IN to/from Viburnum Foetidum (Plant) Rel Props:Reference:
259. Outgoing r'ship FOUND_IN to/from Viburnum Furcatum (Plant) Rel Props:Reference:
260. Outgoing r'ship FOUND_IN to/from Viburnum Grandiflorum (Plant) Rel Props:Reference:
261. Outgoing r'ship FOUND_IN to/from Viburnum Grandifolium (Plant) Rel Props:Reference:
262. Outgoing r'ship FOUND_IN to/from Viburnum Lantana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
263. Outgoing r'ship FOUND_IN to/from Viburnum Luzonicum (Plant) Rel Props:Reference:
264. Outgoing r'ship FOUND_IN to/from Viburnum Nervosum (Plant) Rel Props:Reference:
265. Outgoing r'ship FOUND_IN to/from Viburnum Odoratissimum (Plant) Rel Props:Reference:
266. Outgoing r'ship FOUND_IN to/from Viburnum Opulus (Plant) Rel Props:Reference:
267. Outgoing r'ship FOUND_IN to/from Viburnum Orientale (Plant) Rel Props:Reference:
268. Outgoing r'ship FOUND_IN to/from Viburnum Prunifolium (Plant) Rel Props:Reference:
269. Outgoing r'ship FOUND_IN to/from Viburnum Punctatum (Plant) Rel Props:Reference:
270. Outgoing r'ship FOUND_IN to/from Viburnum Rhytidophyllum (Plant) Rel Props:Reference:
271. Outgoing r'ship FOUND_IN to/from Viburnum Sieboldi (Plant) Rel Props:Reference:
272. Outgoing r'ship FOUND_IN to/from Viburnum Suspensum (Plant) Rel Props:Reference:
273. Outgoing r'ship FOUND_IN to/from Viburnum Urceolatum (Plant) Rel Props:Reference:
274. Outgoing r'ship FOUND_IN to/from Xylopia Parvifolia (Plant) Rel Props:Reference:

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Associated Connections 274

Plant Connections 274