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1-BETA,14-ZETA,15,18-O,O,O,O-TETRAACETYLMANOYL_OXIDE
SpectraBase Compound ID JAdZ2b4epnH
InChI InChI=1S/C28H44O9/c1-17(29)33-15-24(36-20(4)32)27(7)14-10-22-26(6,37-27)13-9-21-25(5,16-34-18(2)30)12-11-23(28(21,22)8)35-19(3)31/h21-24H,9-16H2,1-8H3/t21-,22-,23+,24?,25-,26+,27+,28-/m0/s1
InChIKey RBNZRJCHFZDJEB-HLOQLWTKSA-N
Mol Weight 524.7 g/mol
Molecular Formula C28H44O9
Exact Mass 524.298533 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9TGoCGHNIWU
Name 1-BETA,14-ZETA,15,18-O,O,O,O-TETRAACETYLMANOYL_OXIDE
Compound Number 16A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H44O9
InChI InChI=1S/C28H44O9/c1-17(29)33-15-24(36-20(4)32)27(7)14-10-22-26(6,37-27)13-9-21-25(5,16-34-18(2)30)12-11-23(28(21,22)8)35-19(3)31/h21-24H,9-16H2,1-8H3/t21-,22-,23+,24?,25-,26+,27+,28-/m0/s1
InChIKey RBNZRJCHFZDJEB-HLOQLWTKSA-N
Literature Reference Author B.M.FRAGA,P.GONZALEZ,R.GUILLERMO,M.G.HERNANDEZ
Literature Reference Citation J.NAT.PROD.,61,1237(1998)
Literature Reference DOI 10.1021/np980133m
Molecular Weight 524.652 g/mol
Solvent CDCl3
Source File Reference UWMZ1397