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11;CALOUNDRIN-B;(1''R,2R,3''R,4R,5S,5''R,6S,7''R,8''S,9''S,10''R)-2-(6'-ETHYL-3',5'-DIMETHYL-4'-OXOPYRAN-2'-YL)-6-(5''-ETHYL-7''-HYDROXY-8'',9'',10''-TRIMETHYL-2'',4'',6''-TR
SpectraBase Compound ID 8tK5FxMMgMJ
InChI InChI=1S/C29H44O8/c1-11-21-13(3)22(30)15(5)25(34-21)16(6)23(31)14(4)24(32)17(7)29-20(10)28(33)19(9)26(35-29)18(8)27(12-2,36-28)37-29/h14,16-20,24,26,32-33H,11-12H2,1-10H3/t14-,16-,17-,18-,19+,20+,24-,26-,27-,28+,29+/m0/s1
InChIKey DZCOUGLKWPXZPW-MZMBIESFSA-N
Mol Weight 520.7 g/mol
Molecular Formula C29H44O8
Exact Mass 520.303618 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D5zpa9phrhB
Name 11;CALOUNDRIN-B;(1''R,2R,3''R,4R,5S,5''R,6S,7''R,8''S,9''S,10''R)-2-(6'-ETHYL-3',5'-DIMETHYL-4'-OXOPYRAN-2'-YL)-6-(5''-ETHYL-7''-HYDROXY-8'',9'',10''-TRIMETHYL-2'',4'',6''-TR
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H44O8
InChI InChI=1S/C29H44O8/c1-11-21-13(3)22(30)15(5)25(34-21)16(6)23(31)14(4)24(32)17(7)29-20(10)28(33)19(9)26(35-29)18(8)27(12-2,36-28)37-29/h14,16-20,24,26,32-33H,11-12H2,1-10H3/t14-,16-,17-,18-,19+,20+,24-,26-,27-,28+,29+/m0/s1
InChIKey DZCOUGLKWPXZPW-MZMBIESFSA-N
Literature Reference Author J.T.BLANCHFIELD,D.J.BRECKNELL,I.M.BRERETON,M.J.GARSON,D.D.JO NES
Literature Reference Citation AUSTR.J.CHEM.,47,2255(1994)
Literature Reference DOI 10.1071/ch9942255
Molecular Weight 520.664 g/mol
Solvent CDCl3
Source File Reference UWVP5513