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(2S,3R,6S)-3-Benzyloxy-2-benzyloxymethoxy-3-ethyl-6,7-isopropylidenedioxyheptane
SpectraBase Compound ID GlKPzyLDSy2
InChI InChI=1S/C27H38O5/c1-5-27(31-19-24-14-10-7-11-15-24,17-16-25-20-30-26(3,4)32-25)22(2)29-21-28-18-23-12-8-6-9-13-23/h6-15,22,25H,5,16-21H2,1-4H3/t22-,25-,27+/m0/s1
InChIKey VAQHJWIWGWURDV-RIACCQAKSA-N
Mol Weight 442.6 g/mol
Molecular Formula C27H38O5
Exact Mass 442.271924 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LVteXeJsBcB
Name (2S,3R,6S)-3-Benzyloxy-2-benzyloxymethoxy-3-ethyl-6,7-isopropylidenedioxyheptane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H38O5
InChI InChI=1S/C27H38O5/c1-5-27(31-19-24-14-10-7-11-15-24,17-16-25-20-30-26(3,4)32-25)22(2)29-21-28-18-23-12-8-6-9-13-23/h6-15,22,25H,5,16-21H2,1-4H3/t22-,25-,27+/m0/s1
InChIKey VAQHJWIWGWURDV-RIACCQAKSA-N
Molecular Weight 442.596 g/mol
SMILES C1(O[C@@](CC[C@@](OCc2ccccc2)([C@@](OCOCc2ccccc2)(C)[H])CC)(CO1)[H])(C)C
SPLASH splash10-0006-9010000000-7036dff9a1804267f0d1
Source of Spectrum E1-37-1714-0
Synonyms 3-O-benzyl-2-O-[(benzyloxy)methyl]-1,4,5-trideoxy-3-C-ethyl-6,7-O-(1-methylethylidene)-D-ribo-heptitol
Wiley ID 1517864