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CIS-FK-506
SpectraBase Compound ID E2ZRKgGEBxv
InChI InChI=1S/C43H67NO12/c1-10-30-18-24(2)17-25(3)19-36(53-8)39-37(54-9)21-27(5)43(51,56-39)40(48)41(49)44-16-12-11-13-31(44)42(50)55-38(28(6)33(46)23-34(30)47)26(4)20-29-14-15-32(45)35(22-29)52-7/h10,18,20,25,27-33,35-39,45-46,51H,1,11-17,19,21-23H2,2-9H3/b24-18-,26-20+/t25?,27?,28?,29-,30+,31-,32+,33-,35+,36-,37-,38+,39+,43+/m0/s1
InChIKey LJLHVODPLBZJBW-DBYZSUTNSA-N
Mol Weight 790.0 g/mol
Molecular Formula C43H67NO12
Exact Mass 789.466327 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C85utsIQYB9
Name CIS-FK-506
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H67NO12
InChI InChI=1S/C43H67NO12/c1-10-30-18-24(2)17-25(3)19-36(53-8)39-37(54-9)21-27(5)43(51,56-39)40(48)41(49)44-16-12-11-13-31(44)42(50)55-38(28(6)33(46)23-34(30)47)26(4)20-29-14-15-32(45)35(22-29)52-7/h10,18,20,25,27-33,35-39,45-46,51H,1,11-17,19,21-23H2,2-9H3/b24-18-,26-20+/t25?,27?,28?,29-,30+,31-,32+,33-,35+,36-,37-,38+,39+,43+/m0/s1
InChIKey LJLHVODPLBZJBW-DBYZSUTNSA-N
Literature Reference Author K.BAUMANN,K.HOEGENAUER,G.SCHULZ,A.STECK
Literature Reference Citation MAGN.RES.CHEM.,40,443(2002)
Literature Reference DOI 10.1002/mrc.1044
Molecular Weight 790.004 g/mol
Solvent CDCl3
Source File Reference UWKP6889