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SQUADIOLIN_C
SpectraBase Compound ID 9ZhPAA4qDtI
InChI InChI=1S/C35H64O7/c1-3-4-5-6-7-8-12-15-20-31(37)32(38)21-16-17-22-33(39)34-24-23-30(42-34)19-14-11-9-10-13-18-29(36)26-28-25-27(2)41-35(28)40/h25,27,29-34,36-39H,3-24,26H2,1-2H3/t27-,29?,30-,31+,32+,33+,34+/m1/s1
InChIKey RQLJYFJCJLGTPE-VVWFVBQHSA-N
Mol Weight 596.9 g/mol
Molecular Formula C35H64O7
Exact Mass 596.465204 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 683ETY7XA7F
Name SQUADIOLIN_C
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H64O7
InChI InChI=1S/C35H64O7/c1-3-4-5-6-7-8-12-15-20-31(37)32(38)21-16-17-22-33(39)34-24-23-30(42-34)19-14-11-9-10-13-18-29(36)26-28-25-27(2)41-35(28)40/h25,27,29-34,36-39H,3-24,26H2,1-2H3/t27-,29?,30-,31+,32+,33+,34+/m1/s1
InChIKey RQLJYFJCJLGTPE-VVWFVBQHSA-N
Literature Reference Author C.C.LIAW,Y.L.YANG,M.CHEN,F.R.CHANG,S.L.CHEN,S.H.WU,Y.C.WU
Literature Reference Citation J.NAT.PROD.,71,764(2008)
Literature Reference DOI 10.1021/np0704957
Molecular Weight 596.889 g/mol
Sample ID 28191
Solvent CDCl3