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(3R*,3aR*,6aS*,10S*,10aR*)-Methyl 3-benzyloxy-5-oxo-10-(1,3,6-trioxaheptyl)perhydronaphtho[1,8a-c]furan-3-carboxylate
SpectraBase Compound ID A00A8POLdyq
InChI InChI=1S/C25H34O8/c1-28-11-12-30-17-31-22-10-6-9-19-13-20(26)14-21-24(19,22)16-33-25(21,23(27)29-2)32-15-18-7-4-3-5-8-18/h3-5,7-8,19,21-22H,6,9-17H2,1-2H3/t19-,21+,22-,24+,25+/m0/s1
InChIKey AQMUMCSIWHRDSR-MXUDVLDRSA-N
Mol Weight 462.5 g/mol
Molecular Formula C25H34O8
Exact Mass 462.225368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HD6gTUTgqXX
Name (3R*,3aR*,6aS*,10S*,10aR*)-Methyl 3-benzyloxy-5-oxo-10-(1,3,6-trioxaheptyl)perhydronaphtho[1,8a-c]furan-3-carboxylate
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Formula C25H34O8
InChI InChI=1S/C25H34O8/c1-28-11-12-30-17-31-22-10-6-9-19-13-20(26)14-21-24(19,22)16-33-25(21,23(27)29-2)32-15-18-7-4-3-5-8-18/h3-5,7-8,19,21-22H,6,9-17H2,1-2H3/t19-,21+,22-,24+,25+/m0/s1
InChIKey AQMUMCSIWHRDSR-MXUDVLDRSA-N
Molecular Weight 462.539 g/mol
SMILES [C@]1([C@]2([C@]3([C@@](CCC[C@@]3(OCOCCOC)[H])(CC(C2)=O)[H])CO1)[H])(C(=O)OC)OCc1ccccc1
SPLASH splash10-0006-9000000000-44137b7358b162688a67
Source of Spectrum KC-1992-2754-39
Wiley ID 776930