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D-gluco-Heptitol, 2,6,7-trideoxy-5-O-[(4-methoxyphenyl)methyl]-2-methyl-4-C-methyl-3,4-O-(1-methylethylidene)-
SpectraBase Compound ID GIX7PpRqwyW
InChI InChI=1S/C20H32O5/c1-7-17(23-13-15-8-10-16(22-6)11-9-15)20(5)18(14(2)12-21)24-19(3,4)25-20/h8-11,14,17-18,21H,7,12-13H2,1-6H3/t14-,17-,18-,20+/m0/s1
InChIKey LPZROXOVTMOQIR-PRIDNEQBSA-N
Mol Weight 352.5 g/mol
Molecular Formula C20H32O5
Exact Mass 352.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HgPdp7rBQTQ
Name D-gluco-Heptitol, 2,6,7-trideoxy-5-O-[(4-methoxyphenyl)methyl]-2-methyl-4-C-methyl-3,4-O-(1-methylethylidene)-
CAS Registry Number 98003-95-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O5
InChI InChI=1S/C20H32O5/c1-7-17(23-13-15-8-10-16(22-6)11-9-15)20(5)18(14(2)12-21)24-19(3,4)25-20/h8-11,14,17-18,21H,7,12-13H2,1-6H3/t14-,17-,18-,20+/m0/s1
InChIKey LPZROXOVTMOQIR-PRIDNEQBSA-N
Molecular Weight 352.471 g/mol
SMILES OC[C@@]([C@]1([C@](OC(C)(C)O1)([C@@](OCc1ccc(cc1)OC)(CC)[H])C)[H])(C)[H]
SPLASH splash10-00xr-0900000000-8510b36a51fb38bedfd3
Source of Spectrum KC-1985-12-20
Synonyms (2S,3R,4R,5R)-1-hydroxy-3,4-isopropylidene-5-(4-methoxy-benzyloxy)-2,4-dimethylheptane[2,6,7-trideoxy-3,4-O-isopropylidene-5-O-(4-methoxybenzyl)-2,4-di-c-methyl-D-gluco-heptitol 1,2,6-trideoxy-3-O-(4-methoxybenzyl)-6-methyl-4-C-methyl-4,5-O-(1-methylethylidene)-L-altro-heptitol
Wiley ID 1343321