3-epi-wilsonine

AlkaPlorer ID: AK043071

Synonym: '', 'Epiwilsonine', 'epi-Wilsonine', 'Wilsonine'

IUPAC Name: (1R,13S,15R,18R)-4,5,18-trimethoxy-14-oxa-11-azapentacyclo[9.8.0.01,15.02,7.013,15]nonadeca-2,4,6,16-tetraene

Structure

SMILES: COC1=C(OC)C=C2C(=C1)CCCN1C[C@@H]3O[C@@]34C=C[C@H](OC)C[C@]214

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InChI: InChI=1S/C20H25NO4/c1-22-14-6-7-20-18(25-20)12-21-8-4-5-13-9-16(23-2)17(24-3)10-15(13)19(20,21)11-14/h6-7,9-10,14,18H,4-5,8,11-12H2,1-3H3/t14-,18-,19+,20-/m0/s1

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InChIKey: JCKPCZAYDZJZIL-GAZPGATBSA-N

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Properties Information

Molecule Weight: 343.42300000000006

TPSA: 43.46000000000001

MolLogP: 2.2734000000000005

Number of H-Donors: 0

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information