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(+)-6,7-Diacetylalmuheptolide-B [(4R,5R,6R,7R,8R)-5-ethoxy-6,7-diacetoxy-8-phenyl-1-oxaoctan-2-one]
SpectraBase Compound ID FTrOZ4eLIVr
InChI InChI=1S/C19H24O7/c1-4-23-15-10-11-16(22)26-17(14-8-6-5-7-9-14)19(25-13(3)21)18(15)24-12(2)20/h5-9,15,17-19H,4,10-11H2,1-3H3/t15-,17-,18-,19-/m1/s1
InChIKey PYVLFUGICDWJSM-NXWXRZEISA-N
Mol Weight 364.39 g/mol
Molecular Formula C19H24O7
Exact Mass 364.152203 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4mfiJKaoFf4
Name (+)-6,7-Diacetylalmuheptolide-B [(4R,5R,6R,7R,8R)-5-ethoxy-6,7-diacetoxy-8-phenyl-1-oxaoctan-2-one]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O7
InChI InChI=1S/C19H24O7/c1-4-23-15-10-11-16(22)26-17(14-8-6-5-7-9-14)19(25-13(3)21)18(15)24-12(2)20/h5-9,15,17-19H,4,10-11H2,1-3H3/t15-,17-,18-,19-/m1/s1
InChIKey PYVLFUGICDWJSM-NXWXRZEISA-N
Molecular Weight 364.394 g/mol
SMILES [C@]1([C@](OC(=O)C)([C@@](CCC(O[C@@]1(c1ccccc1)[H])=O)(OCC)[H])[H])(OC(=O)C)[H]
SPLASH splash10-00kg-3691000000-6ef7c58da2f611d2ef9e
Source of Spectrum F2-41-5164-2
Synonyms Acetic acid [(2R,3R,4R,5R)-3-acetyloxy-5-ethoxy-8-oxo-2-phenyl-4-oxocanyl] ester [(2R,3R,4R,5R)-3-acetyloxy-5-ethoxy-8-oxo-2-phenyloxocan-4-yl] acetate [(2R,3R,4R,5R)-3-acetoxy-5-ethoxy-8-oxo-2-phenyl-oxocan-4-yl] acetate [(2R,3R,4R,5R)-3-acetyloxy-5-ethoxy-8-oxidanylidene-2-phenyl-oxocan-4-yl] ethanoate
Wiley ID 1599940