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(1R,2S,3S,4S,5R,6R)-3-o-Acetyl-4,5-di-o-benzyl-6-benzyloxymethyl-1,2-epoxycyclohexane-3,4,5-triol
SpectraBase Compound ID EIzj8C7ZHdR
InChI InChI=1S/C30H32O6/c1-21(31)35-30-28(34-19-24-15-9-4-10-16-24)26(33-18-23-13-7-3-8-14-23)25(27-29(30)36-27)20-32-17-22-11-5-2-6-12-22/h2-16,25-30H,17-20H2,1H3/t25-,26-,27-,28+,29-,30+/m1/s1
InChIKey WXCYSSMWKFKOEQ-XFKPVUIASA-N
Mol Weight 488.6 g/mol
Molecular Formula C30H32O6
Exact Mass 488.219889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7MsyGfeBFIl
Name (1R,2S,3S,4S,5R,6R)-3-O-Acetyl-4,5-di-O-benzyl-6-benzyloxymethyl-1,2-epoxycyclohexane-3,4,5-triol
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Formula C30H32O6
InChI InChI=1S/C30H32O6/c1-21(31)35-30-28(34-19-24-15-9-4-10-16-24)26(33-18-23-13-7-3-8-14-23)25(27-29(30)36-27)20-32-17-22-11-5-2-6-12-22/h2-16,25-30H,17-20H2,1H3/t25-,26-,27-,28+,29-,30+/m1/s1
InChIKey WXCYSSMWKFKOEQ-XFKPVUIASA-N
Molecular Weight 488.580 g/mol
SMILES [C@]12([C@@]([C@](COCc3ccccc3)([C@]([C@@]([C@@]1(OC(=O)C)[H])(OCc1ccccc1)[H])(OCc1ccccc1)[H])[H])(O2)[H])[H]
SPLASH splash10-0006-9020000000-46435af826b531ac4cff
Source of Spectrum KC-0-2024-30
Synonyms (1S,2S,3S,4R,5R,6R)-3,4-bis(benzyloxy)-5-[(benzyloxy)methyl]-7-oxabicyclo[4.1.0]hept-2-yl acetate Acetic acid [(1R,2R,3R,4S,5S,6R)-3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-7-oxabicyclo[4.1.0]heptan-5-yl] ester [(1R,2R,3R,4S,5S,6R)-3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-7-oxabicyclo[4.1.0]heptan-5-yl] acetate [(1R,2R,3R,4S,5S,6R)-3,4-dibenzyloxy-2-(benzyloxymethyl)-7-oxabicyclo[4.1.0]heptan-5-yl] acetate [(1R,2R,3R,4S,5S,6R)-3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-7-oxabicyclo[4.1.0]heptan-5-yl] ethanoate
Wiley ID 781661