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JASMOLACTONE-D-PENTAACETATE
SpectraBase Compound ID EWkmXSc2Vls
InChI InChI=1S/C36H38O16/c1-19(37)48-28-8-6-24(14-30(28)50-21(3)39)10-12-44-32-18-46-33(42)16-26-27(17-47-36(34(26)32)52-23(5)41)35(43)45-13-11-25-7-9-29(49-20(2)38)31(15-25)51-22(4)40/h6-9,14-15,17,26,32,34,36H,10-13,16,18H2,1-5H3/t26-,32-,34+,36+/m1/s1
InChIKey GRLBIPPCWAOBGT-PUXWDWPNSA-N
Mol Weight 726.7 g/mol
Molecular Formula C36H38O16
Exact Mass 726.215985 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7AIyzyBPTOf
Name JASMOLACTONE-D-PENTAACETATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H38O16
InChI InChI=1S/C36H38O16/c1-19(37)48-28-8-6-24(14-30(28)50-21(3)39)10-12-44-32-18-46-33(42)16-26-27(17-47-36(34(26)32)52-23(5)41)35(43)45-13-11-25-7-9-29(49-20(2)38)31(15-25)51-22(4)40/h6-9,14-15,17,26,32,34,36H,10-13,16,18H2,1-5H3/t26-,32-,34+,36+/m1/s1
InChIKey GRLBIPPCWAOBGT-PUXWDWPNSA-N
Literature Reference Author Y.C.SHEN,C.H.CHEN
Literature Reference Citation J.NAT.PROD.,52,1060(1989)
Literature Reference DOI 10.1021/np50065a024
Molecular Weight 726.688 g/mol
Solvent CDCl3
Source File Reference UWTS447