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Napoleogenin-B
SpectraBase Compound ID JcnBCF6QdeH
InChI InChI=1S/C46H72O12/c1-12-24(3)38(53)56-34-26(5)55-40(33(51)35(34)57-39(54)25(4)13-2)58-37-36(52)46(23-48)28(20-41(37,6)7)27-14-15-30-42(8)18-17-31(49)43(9,22-47)29(42)16-19-44(30,10)45(27,11)21-32(46)50/h12-14,26,28-37,40,47-52H,15-23H2,1-11H3/b24-12-,25-13-/t26-,28?,29?,30?,31+,32-,33-,34+,35-,36+,37+,40+,42+,43-,44-,45-,46+/m1/s1
InChIKey AKKIXIYYMOHCOW-CQADOAGGSA-N
Mol Weight 817.1 g/mol
Molecular Formula C46H72O12
Exact Mass 816.502378 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DIL2wAdBN8m
Name NAPOLEOGENIN-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H72O12
InChI InChI=1S/C46H72O12/c1-12-24(3)38(53)56-34-26(5)55-40(33(51)35(34)57-39(54)25(4)13-2)58-37-36(52)46(23-48)28(20-41(37,6)7)27-14-15-30-42(8)18-17-31(49)43(9,22-47)29(42)16-19-44(30,10)45(27,11)21-32(46)50/h12-14,26,28-37,40,47-52H,15-23H2,1-11H3/b24-12-,25-13-/t26-,28?,29?,30?,31+,32-,33-,34+,35-,36+,37+,40+,42+,43-,44-,45-,46+/m1/s1
InChIKey AKKIXIYYMOHCOW-CQADOAGGSA-N
Literature Reference Author Y.CHEN,T.TAKEDA,Y.OGIHARA
Literature Reference Citation CHEM.PHARM.BULL.,33,127(1985)
Literature Reference DOI 10.1248/cpb.33.127
Molecular Weight 817.070 g/mol
Solvent PYRIDINE-D5
Source File Reference UWBK190