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(1R,2R,3R,4S,5S)-4,5-Di-O-acetyl-3-O-benzyl-5-((benzyloxy)methyl)cyclohexane-1,2,3,4,5-pentol

View entire compound with spectra: 1 MS (GC)

(1R,2R,3R,4S,5S)-4,5-Di-O-acetyl-3-O-benzyl-5-((benzyloxy)methyl)cyclohexane-1,2,3,4,5-pentol
SpectraBase Compound ID CcqJTLgEjo9
InChI InChI=1S/C25H30O8/c1-17(26)32-24-23(31-15-20-11-7-4-8-12-20)22(29)21(28)13-25(24,33-18(2)27)16-30-14-19-9-5-3-6-10-19/h3-12,21-24,28-29H,13-16H2,1-2H3/t21-,22-,23-,24+,25+/m1/s1
InChIKey FRFOQKGTHDEXLN-LFCBLZOASA-N
Mol Weight 458.51 g/mol
Molecular Formula C25H30O8
Exact Mass 458.194068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HSTzyClFeAD
Name (1R,2R,3R,4S,5S)-4,5-Di-O-acetyl-3-O-benzyl-5-((benzyloxy)methyl)cyclohexane-1,2,3,4,5-pentol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30O8
InChI InChI=1S/C25H30O8/c1-17(26)32-24-23(31-15-20-11-7-4-8-12-20)22(29)21(28)13-25(24,33-18(2)27)16-30-14-19-9-5-3-6-10-19/h3-12,21-24,28-29H,13-16H2,1-2H3/t21-,22-,23-,24+,25+/m1/s1
InChIKey FRFOQKGTHDEXLN-LFCBLZOASA-N
Molecular Weight 458.507 g/mol
SMILES O[C@]1([C@]([C@]([C@@]([C@@](C1)(OC(=O)C)COCc1ccccc1)(OC(=O)C)[H])(OCc1ccccc1)[H])(O)[H])[H]
SPLASH splash10-01ox-9060000000-33d1246ee4230c0f850d
Source of Spectrum J-61-8475-10
Synonyms (1S,2S,3R,4R,5R)-2-(acetyloxy)-3-(benzyloxy)-1-[(benzyloxy)methyl]-4,5-dihydroxycyclohexyl acetate Acetic acid[(1S,2S,4R,5R,6R)-2-acetoxy-6-benzoxy-2-(benzoxymethyl)-4,5-dihydroxy-cyclohexyl]ester Acetic acid[(1S,2S,4R,5R,6R)-2-acetyloxy-4,5-dihydroxy-6-phenylmethoxy-2-(phenylmethoxymethyl)cyclohexyl]ester [(1S,2S,4R,5R,6R)-2-acetoxy-6-benzyloxy-2-(benzyloxymethyl)-4,5-dihydroxy-cyclohexyl]acetate [(1S,2S,4R,5R,6R)-2-acetyloxy-4,5-bis(oxidanyl)-6-phenylmethoxy-2-(phenylmethoxymethyl)cyclohexyl]ethanoate [(1S,2S,4R,5R,6R)-2-acetyloxy-4,5-dihydroxy-6-phenylmethoxy-2-(phenylmethoxymethyl)cyclohexyl]acetate Acetic acid [(1S,2S,4R,5R,6R)-2-acetyloxy-4,5-dihydroxy-6-phenylmethoxy-2-(phenylmethoxymethyl)cyclohexyl] ester [(1S,2S,4R,5R,6R)-2-acetyloxy-4,5-dihydroxy-6-phenylmethoxy-2-(phenylmethoxymethyl)cyclohexyl] acetate [(1S,2S,4R,5R,6R)-2-acetoxy-6-benzyloxy-2-(benzyloxymethyl)-4,5-dihydroxy-cyclohexyl] acetate [(1S,2S,4R,5R,6R)-2-acetyloxy-4,5-bis(oxidanyl)-6-phenylmethoxy-2-(phenylmethoxymethyl)cyclohexyl] ethanoate
Wiley ID 1389872