[(2R,3S,4R,4aR,4bR,5S,8aS,9aS)-3,4-diacetoxy-7-iodo-5-methyl-3,4,4a,4b,5,8,8a,9a-octahydro-2H-pyrano[2,3-b]benzofuran-2-yl]methyl acetate

SpectraBase Compound ID	GsyPSqhboVc
InChI	InChI=1S/C19H25IO8/c1-8-5-12(20)6-13-15(8)16-18(26-11(4)23)17(25-10(3)22)14(7-24-9(2)21)28-19(16)27-13/h5,8,13-19H,6-7H2,1-4H3/t8-,13+,14-,15+,16-,17-,18-,19+/m1/s1
InChIKey	FEZLMIUBZKIHLA-LYOGNUMUSA-N Google Search
Mol Weight	508.31 g/mol
Molecular Formula	C19H25IO8
Exact Mass	508.059413 g/mol

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SpectraBase Spectrum ID	145hr1H07Hw
Name	[(2R,3S,4R,4aR,4bR,5S,8aS,9aS)-3,4-diacetoxy-7-iodo-5-methyl-3,4,4a,4b,5,8,8a,9a-octahydro-2H-pyrano[2,3-b]benzofuran-2-yl]methyl acetate
Alternate Name(s)	[(2R,3S,4R,4aR,4bR,5S,8aS,9aS)-3,4-diacetyloxy-7-iodanyl-5-methyl-3,4,4a,4b,5,8,8a,9a-octahydro-2H-pyrano[2,3-b][1]benzofuran-2-yl]methyl ethanoate [(2R,3S,4R,4aR,4bR,5S,8aS,9aS)-3,4-diacetyloxy-7-iodo-5-methyl-3,4,4a,4b,5,8,8a,9a-octahydro-2H-pyrano[2,3-b][1]benzofuran-2-yl]methyl acetate acetic acid [(2R,3S,4R,4aR,4bR,5S,8aS,9aS)-3,4-diacetyloxy-7-iodo-5-methyl-3,4,4a,4b,5,8,8a,9a-octahydro-2H-pyrano[2,3-b]benzofuran-2-yl]methyl ester
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C19H25IO8
InChI	InChI=1S/C19H25IO8/c1-8-5-12(20)6-13-15(8)16-18(26-11(4)23)17(25-10(3)22)14(7-24-9(2)21)28-19(16)27-13/h5,8,13-19H,6-7H2,1-4H3/t8-,13+,14-,15+,16-,17-,18-,19+/m1/s1
InChIKey	FEZLMIUBZKIHLA-LYOGNUMUSA-N
Molecular Weight	508.305 g/mol
SMILES	[C@@]12([C@@](O[C@@]3([C@@]2([C@@](C=C(I)C3)(C)[H])[H])[H])(O[C@@]([C@]([C@@]1(OC(=O)C)[H])(OC(=O)C)[H])(COC(=O)C)[H])[H])[H]
SPLASH	splash10-0a4i-0900000000-4ed2f1435370d1632c4c
Source of Spectrum	F-53-8419-0
Wiley ID	802603