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13-EPI-9-DEACETYL-XENICIN
SpectraBase Compound ID E2bJZXRJiTL
InChI InChI=1S/C26H36O8/c1-14(2)10-23(32-17(5)27)25(33-18(6)28)22-13-31-26(34-19(7)29)24-16(4)12-20(30)11-15(3)8-9-21(22)24/h10-11,13,20-21,23-26,30H,4,8-9,12H2,1-3,5-7H3/b15-11+/t20-,21+,23+,24-,25+,26+/m0/s1
InChIKey BVHUFJCFOXAURN-FJDHLGECSA-N
Mol Weight 476.6 g/mol
Molecular Formula C26H36O8
Exact Mass 476.241018 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BtxC3ELrIvf
Name 13-EPI-9-DEACETYL-XENICIN
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H36O8
InChI InChI=1S/C26H36O8/c1-14(2)10-23(32-17(5)27)25(33-18(6)28)22-13-31-26(34-19(7)29)24-16(4)12-20(30)11-15(3)8-9-21(22)24/h10-11,13,20-21,23-26,30H,4,8-9,12H2,1-3,5-7H3/b15-11+/t20-,21+,23+,24-,25+,26+/m0/s1
InChIKey BVHUFJCFOXAURN-FJDHLGECSA-N
Literature Reference Author B.F.BOWDEN,B.J.CUSACK,A.DANGEL
Literature Reference Citation MAR.DRUGS,1,18(2003)
Literature Reference DOI 10.3390/md101018
Molecular Weight 476.567 g/mol
Solvent CDCl3
Source File Reference UWMZ9314