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Ergobalansinine
SpectraBase Compound ID 5SXuNLiMNDd
InChI InChI=1S/C28H35N5O5/c1-14(2)9-22-25(35)30-15(3)28(37)33(22)26(36)27(4,38-28)31-24(34)17-10-19-18-7-6-8-20-23(18)16(12-29-20)11-21(19)32(5)13-17/h6-8,10,12,14-15,17,21-22,29,37H,9,11,13H2,1-5H3,(H,30,35)(H,31,34)/t15-,17-,21+,22-,27+,28-/m0/s1
InChIKey JUCIBGILHVUKSN-RGJDLGOKSA-N
Mol Weight 521.6 g/mol
Molecular Formula C28H35N5O5
Exact Mass 521.263819 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EFQLZ4ubYFy
Name ERGOBALANSININE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H35N5O5
InChI InChI=1S/C28H35N5O5/c1-14(2)9-22-25(35)30-15(3)28(37)33(22)26(36)27(4,38-28)31-24(34)17-10-19-18-7-6-8-20-23(18)16(12-29-20)11-21(19)32(5)13-17/h6-8,10,12,14-15,17,21-22,29,37H,9,11,13H2,1-5H3,(H,30,35)(H,31,34)/t15-,17-,21+,22-,27+,28-/m0/s1
InChIKey JUCIBGILHVUKSN-RGJDLGOKSA-N
Literature Reference Author R.G.POWELL,R.D.PLATTNER,S.G.YATES,K.CLAY,A.LEUCHTMANN
Literature Reference Citation J.NAT.PROD.,53,1272(1990)
Literature Reference DOI 10.1021/np50071a021
Molecular Weight 521.616 g/mol
Solvent CDCl3
Source File Reference UWRU162