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JURXBTSYRHEANB-MYXYNCHFSA-N
SpectraBase Compound ID 8iN0RorTDch
InChI InChI=1S/C39H57NO5/c1-23(25(3)36(42)40-35(37(43)45-8)27-11-13-28(44-7)14-12-27)9-10-24(2)30-17-18-32-29-15-16-31-26(4)34(41)20-22-39(31,6)33(29)19-21-38(30,32)5/h11-14,18,23-24,26,29-31,33-35,41H,3,9-10,15-17,19-22H2,1-2,4-8H3,(H,40,42)/t23?,24-,26+,29?,30-,31+,33+,34+,35-,38-,39+/m1/s1
InChIKey JURXBTSYRHEANB-MYXYNCHFSA-N
Mol Weight 619.9 g/mol
Molecular Formula C39H57NO5
Exact Mass 619.423674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A6f3LGggVva
Name JURXBTSYRHEANB-MYXYNCHFSA-N
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H57NO5
InChI InChI=1S/C39H57NO5/c1-23(25(3)36(42)40-35(37(43)45-8)27-11-13-28(44-7)14-12-27)9-10-24(2)30-17-18-32-29-15-16-31-26(4)34(41)20-22-39(31,6)33(29)19-21-38(30,32)5/h11-14,18,23-24,26,29-31,33-35,41H,3,9-10,15-17,19-22H2,1-2,4-8H3,(H,40,42)/t23?,24-,26+,29?,30-,31+,33+,34+,35-,38-,39+/m1/s1
InChIKey JURXBTSYRHEANB-MYXYNCHFSA-N
Literature Reference Author F.KONG,R.J.ANDERSEN
Literature Reference Citation J.NAT.PROD.,59,379(1996)
Literature Reference DOI 10.1021/np960098o
Molecular Weight 619.885 g/mol
Solvent CDCl3
Source File Reference UWVP2416