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PERVILLEINE_H;3-ALPHA-(E)-(3,4,5-TRIMETHOXYCINNAMOYLOXY)-6-BETA,7-BETA-DIHYDROXYTROPANE
SpectraBase Compound ID 7vsFQRYsVWv
InChI InChI=1S/C20H27NO7/c1-21-13-9-12(10-14(21)19(24)18(13)23)28-17(22)6-5-11-7-15(25-2)20(27-4)16(8-11)26-3/h5-8,12-14,18-19,23-24H,9-10H2,1-4H3/b6-5+/t12-,13+,14-,18+,19-
InChIKey QXVXOQRJFUTTHT-BBCPJSNUSA-N
Mol Weight 393.44 g/mol
Molecular Formula C20H27NO7
Exact Mass 393.178752 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ZVDSv0HJHB
Name PERVILLEINE_H;3-ALPHA-(E)-(3,4,5-TRIMETHOXYCINNAMOYLOXY)-6-BETA,7-BETA-DIHYDROXYTROPANE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H27NO7
InChI InChI=1S/C20H27NO7/c1-21-13-9-12(10-14(21)19(24)18(13)23)28-17(22)6-5-11-7-15(25-2)20(27-4)16(8-11)26-3/h5-8,12-14,18-19,23-24H,9-10H2,1-4H3/b6-5+/t12-,13+,14-,18+,19-
InChIKey QXVXOQRJFUTTHT-BBCPJSNUSA-N
Literature Reference Author Y.W.CHIN,W.P.JONES,T.J.WAYBRIGHT,T.G.MCCLOUD,P.RASOANAIVO,G. M.CRAGG,J.M.CASSADY,
Literature Reference Citation J.NAT.PROD.,69,414(2006)
Literature Reference DOI 10.1021/np050366v
Molecular Weight 393.437 g/mol
Solvent CDCl3
Source File Reference UWMZ18108