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IRYANTHERIN-K-TETRAACETATE

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IRYANTHERIN-K-TETRAACETATE
SpectraBase Compound ID 4oxn4e0YcFq
InChI InChI=1S/C43H46O11/c1-25(23-32-11-18-35(19-12-32)51-27(3)44)26(2)40(33-14-20-36(21-15-33)52-28(4)45)42-39(53-29(5)46)24-38(50-8)41(43(42)54-30(6)47)37(48)22-13-31-9-16-34(49-7)17-10-31/h9-12,14-21,24-26,40H,13,22-23H2,1-8H3/t25-,26+,40-/m1/s1
InChIKey QJTRRPWYMUITAL-LLRCYYNMSA-N
Mol Weight 738.8 g/mol
Molecular Formula C43H46O11
Exact Mass 738.304012 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A7bCWahKy94
Name IRYANTHERIN-K-TETRAACETATE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H46O11
InChI InChI=1S/C43H46O11/c1-25(23-32-11-18-35(19-12-32)51-27(3)44)26(2)40(33-14-20-36(21-15-33)52-28(4)45)42-39(53-29(5)46)24-38(50-8)41(43(42)54-30(6)47)37(48)22-13-31-9-16-34(49-7)17-10-31/h9-12,14-21,24-26,40H,13,22-23H2,1-8H3/t25-,26+,40-/m1/s1
InChIKey QJTRRPWYMUITAL-LLRCYYNMSA-N
Literature Reference Author D.H.S.SILVA,S.C.DAVINO,S.B.D.M.BARROS,M.YOSHIDA
Literature Reference Citation J.NAT.PROD.,62,1475(1999)
Literature Reference DOI 10.1021/np980509w
Molecular Weight 738.832 g/mol
Solvent CDCl3
Source File Reference UWCP8693