John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=1j1gvawJFMc SpectraBase Spectrum ID=BnfqucV2NBd

(accessed ).
INCARVILLATEINE-E
SpectraBase Compound ID 1j1gvawJFMc
InChI InChI=1S/C42H58N2O8/c1-21-17-43(5)19-29-23(3)33(15-27(21)29)51-41(47)39-37(25-9-11-31(45)35(13-25)49-7)40(38(39)26-10-12-32(46)36(14-26)50-8)42(48)52-34-16-28-22(2)18-44(6)20-30(28)24(34)4/h9-14,21-24,27-30,33-34,37-40,45-46H,15-20H2,1-8H3/t21-,22-,23-,24-,27-,28-,29-,30-,33+,34+,37-,38-,39-,40-/m0/s1
InChIKey VQKTZIKAARDZIA-FYBVMHBNSA-N
Mol Weight 718.9 g/mol
Molecular Formula C42H58N2O8
Exact Mass 718.419317 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BnfqucV2NBd
Name INCARVILLATEINE-E
Compound Number 4
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H58N2O8
InChI InChI=1S/C42H58N2O8/c1-21-17-43(5)19-29-23(3)33(15-27(21)29)51-41(47)39-37(25-9-11-31(45)35(13-25)49-7)40(38(39)26-10-12-32(46)36(14-26)50-8)42(48)52-34-16-28-22(2)18-44(6)20-30(28)24(34)4/h9-14,21-24,27-30,33-34,37-40,45-46H,15-20H2,1-8H3/t21-,22-,23-,24-,27-,28-,29-,30-,33+,34+,37-,38-,39-,40-/m0/s1
InChIKey VQKTZIKAARDZIA-FYBVMHBNSA-N
Literature Reference Author Y.M.CHI,M.NAKAMURA,X.Y.ZHAO,T.YOSHIZAWA,W.M.YAN,F.HASHIMOTO, J.KINJO,T.NOHARA
Literature Reference Citation CHEM.PHARM.BULL.,53,1178(2005)
Literature Reference DOI 10.1248/cpb.53.1178
Molecular Weight 718.931 g/mol
Sample ID 54088
Solvent Unknown
SpectraBase Batch ID KGR4BzexprW