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(2R,3R,4R,4aR,8aS)-3-Benzyloxy-2-(benzyloxymethyl)octahydropyrano[3,2-b]pyran-4-yl 4-nitrobenzoate
SpectraBase Compound ID 5QkpfDCO681
InChI InChI=1S/C30H31NO8/c32-30(23-13-15-24(16-14-23)31(33)34)39-29-27-25(12-7-17-36-27)38-26(20-35-18-21-8-3-1-4-9-21)28(29)37-19-22-10-5-2-6-11-22/h1-6,8-11,13-16,25-29H,7,12,17-20H2/t25-,26+,27+,28+,29+/m0/s1
InChIKey JIZOCCJIEAIKCG-MMBNBZRISA-N
Mol Weight 533.58 g/mol
Molecular Formula C30H31NO8
Exact Mass 533.204967 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9sAsv6p7PFL
Name (2R,3R,4R,4aR,8aS)-3-Benzyloxy-2-(benzyloxymethyl)octahydropyrano[3,2-b]pyran-4-yl 4-nitrobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H31NO8
InChI InChI=1S/C30H31NO8/c32-30(23-13-15-24(16-14-23)31(33)34)39-29-27-25(12-7-17-36-27)38-26(20-35-18-21-8-3-1-4-9-21)28(29)37-19-22-10-5-2-6-11-22/h1-6,8-11,13-16,25-29H,7,12,17-20H2/t25-,26+,27+,28+,29+/m0/s1
InChIKey JIZOCCJIEAIKCG-MMBNBZRISA-N
Molecular Weight 533.577 g/mol
SMILES C(c1ccc(cc1)N(=O)=O)(=O)O[C@@]1([C@]2([C@@](O[C@@]([C@]1(OCc1ccccc1)[H])(COCc1ccccc1)[H])(CCCO2)[H])[H])[H]
SPLASH splash10-0006-9700100000-a1844948deb2577d4e20
Source of Spectrum J-65-8825-12
Synonyms 4-Nitrobenzoic acid[(2R,3R,4R,4aR,8aS)-3-benzoxy-2-(benzoxymethyl)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-4-yl]ester 4-Nitrobenzoic acid[(2R,3R,4R,4aR,8aS)-3-phenylmethoxy-2-(phenylmethoxymethyl)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-4-yl]ester [(2R,3R,4R,4aR,8aS)-3-benzyloxy-2-(benzyloxymethyl)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-4-yl]4-nitrobenzoate [(2R,3R,4R,4aR,8aS)-3-phenylmethoxy-2-(phenylmethoxymethyl)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-4-yl]4-nitrobenzoate 4-Nitrobenzoic acid [(2R,3R,4R,4aR,8aS)-3-phenylmethoxy-2-(phenylmethoxymethyl)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-4-yl] ester [(2R,3R,4R,4aR,8aS)-3-benzyloxy-2-(benzyloxymethyl)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-4-yl] 4-nitrobenzoate [(2R,3R,4R,4aR,8aS)-3-phenylmethoxy-2-(phenylmethoxymethyl)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-4-yl] 4-nitrobenzoate
Wiley ID 1533972