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Juniperoside iii, 4ac derivative

View entire compound with spectra: 1 NMR, and 1 FTIR

Juniperoside iii, 4ac derivative
SpectraBase Compound ID uSxZWbbgmi
InChI InChI=1S/C23H28O11/c1-11-8-7-9-17(19(11)12(2)24)33-23-22(32-16(6)28)21(31-15(5)27)20(30-14(4)26)18(34-23)10-29-13(3)25/h7-9,18,20-23H,10H2,1-6H3/t18-,20-,21+,22-,23-/m1/s1
InChIKey ONYONMPFRDFLAV-DODNOZFWSA-N
Mol Weight 480.47 g/mol
Molecular Formula C23H28O11
Exact Mass 480.163162 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B5oCwK3Uqcl
Name Juniperoside iii, 4ac derivative
Comments Computed using HOSE algorithm
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Exact Mass 480.163161711 u
Formula C23H28O11
InChI InChI=1S/C23H28O11/c1-11-8-7-9-17(19(11)12(2)24)33-23-22(32-16(6)28)21(31-15(5)27)20(30-14(4)26)18(34-23)10-29-13(3)25/h7-9,18,20-23H,10H2,1-6H3/t18-,20-,21+,22-,23-/m1/s1
InChIKey ONYONMPFRDFLAV-DODNOZFWSA-N
Molecular Weight 480.466 g/mol
SMILES C(C)(C1=C(C=CC=C1C)O[C@]1([C@](OC(=O)C)([C@@](OC(=O)C)([C@](OC(=O)C)([C@](O1)(COC(=O)C)[H])[H])[H])[H])[H])=O