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Rhusonoside A, hexamethyl ether

View entire compound with spectra: 1 NMR

Rhusonoside A, hexamethyl ether
SpectraBase Compound ID 5hTVD42YNME
InChI InChI=1S/C25H48O8/c1-16(27-5)10-11-19-17(12-18(28-6)13-25(19,2)3)14-32-24-23(31-9)22(30-8)21(29-7)20(33-24)15-26-4/h16-24H,10-15H2,1-9H3/t16-,17-,18-,19-,20+,21+,22-,23+,24+/m0/s1
InChIKey DXVWYKJWXNPTLU-NCKPSBMDSA-N
Mol Weight 476.7 g/mol
Molecular Formula C25H48O8
Exact Mass 476.334918 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F9Fka7VxQxm
Name Rhusonoside A, hexamethyl ether
Comments Computed using HOSE algorithm
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Exact Mass 476.334918498 u
Formula C25H48O8
InChI InChI=1S/C25H48O8/c1-16(27-5)10-11-19-17(12-18(28-6)13-25(19,2)3)14-32-24-23(31-9)22(30-8)21(29-7)20(33-24)15-26-4/h16-24H,10-15H2,1-9H3/t16-,17-,18-,19-,20+,21+,22-,23+,24+/m0/s1
InChIKey DXVWYKJWXNPTLU-NCKPSBMDSA-N
Molecular Weight 476.651 g/mol
SMILES CO[C@]1(C[C@@](CO[C@@]2(O[C@](COC)([C@@](OC)([C@](OC)([C@]2(OC)[H])[H])[H])[H])[H])([C@@](C(C)(C)C1)(CC[C@@](OC)(C)[H])[H])[H])[H]