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Lovastatin, trimethylsilyl deriv.
SpectraBase Compound ID H6OHgCmv6l5
InChI InChI=1S/C27H44O5Si/c1-8-18(3)27(29)31-24-14-17(2)13-20-10-9-19(4)23(26(20)24)12-11-21-15-22(16-25(28)30-21)32-33(5,6)7/h9-10,13,17-19,21-24,26H,8,11-12,14-16H2,1-7H3/t17-,18-,19-,21+,22+,23-,24-,26-/m0/s1
InChIKey CZWIDMHJBWCSKO-MLHAPTFHSA-N
Mol Weight 476.7 g/mol
Molecular Formula C27H44O5Si
Exact Mass 476.295801 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 49ARFItle9P
Name Lovastatin, trimethylsilyl deriv.
Comments Computed using HOSE algorithm
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Exact Mass 476.295801047 u
Formula C27H44O5Si
InChI InChI=1S/C27H44O5Si/c1-8-18(3)27(29)31-24-14-17(2)13-20-10-9-19(4)23(26(20)24)12-11-21-15-22(16-25(28)30-21)32-33(5,6)7/h9-10,13,17-19,21-24,26H,8,11-12,14-16H2,1-7H3/t17-,18-,19-,21+,22+,23-,24-,26-/m0/s1
InChIKey CZWIDMHJBWCSKO-MLHAPTFHSA-N
Molecular Weight 476.729 g/mol
SMILES [C@]12([H])C(=C[C@](C)(C[C@@]2(OC([C@@](C)(CC)[H])=O)[H])[H])C=C[C@](C)([C@@]1(CC[C@]1(OC(=O)C[C@](O[Si](C)(C)C)(C1)[H])[H])[H])[H]