6-[1S-(3S,4-Dihydro-8-hydroxy-1-oxo-1H-2-benzopyran-yl)-3-methyl-butyl]amino-4S,5S-dihydroxy-6-oxo-3S-amino-hexanoic aci

SpectraBase Compound ID	pvqbVSPOdR
InChI	InChI=1S/C20H28N2O8/c1-9(2)6-12(22-19(28)18(27)17(26)11(21)8-15(24)25)14-7-10-4-3-5-13(23)16(10)20(29)30-14/h3-5,9,11-12,14,17-18,23,26-27H,6-8,21H2,1-2H3,(H,22,28)(H,24,25)
InChIKey	LOXFXXGTOVWWQV-UHFFFAOYSA-N Google Search
Mol Weight	424.45 g/mol
Molecular Formula	C20H28N2O8
Exact Mass	424.184566 g/mol

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SpectraBase Spectrum ID	KlIsDyl3tNy
Name	6-[1S-(3S,4-Dihydro-8-hydroxy-1-oxo-1H-2-benzopyran-yl)-3-methyl-butyl]amino-4S,5S-dihydroxy-6-oxo-3S-amino-hexanoic aci
CAS Registry Number	77674-99-8
Copyright	Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula	C20H28N2O8
InChI	InChI=1S/C20H28N2O8/c1-9(2)6-12(22-19(28)18(27)17(26)11(21)8-15(24)25)14-7-10-4-3-5-13(23)16(10)20(29)30-14/h3-5,9,11-12,14,17-18,23,26-27H,6-8,21H2,1-2H3,(H,22,28)(H,24,25)
InChIKey	LOXFXXGTOVWWQV-UHFFFAOYSA-N
Instrument Name	Jeol FX-100
Literature Reference	Y. Shimojima, H. Hayashi, T. Ooka, Tetrahedron 40, 2519 (1984).
NMR Standard	TMS
Origin	Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent	DMSO-D6