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(2S,3R)-2-(2-(5-methoxy-4,8,8-trimethyl-2-oxo-2,8,9,10-tetrahydropyrano[2,3-f]chromen-3-yl)acetamido)-3-methylpentanoic acid
SpectraBase Compound ID 44REfLsucQQ
InChI InChI=1S/C24H31NO7/c1-7-12(2)20(22(27)28)25-18(26)10-15-13(3)19-17(30-6)11-16-14(21(19)31-23(15)29)8-9-24(4,5)32-16/h11-12,20H,7-10H2,1-6H3,(H,25,26)(H,27,28)
InChIKey QQTUUZPXDXTEBZ-UHFFFAOYSA-N
Mol Weight 445.51 g/mol
Molecular Formula C24H31NO7
Exact Mass 445.210052 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KAbfLjnsbfZ
Name (2S,3R)-2-(2-(5-methoxy-4,8,8-trimethyl-2-oxo-2,8,9,10-tetrahydropyrano[2,3-f]chromen-3-yl)acetamido)-3-methylpentanoic acid
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C24H31NO7/c1-7-12(2)20(22(27)28)25-18(26)10-15-13(3)19-17(30-6)11-16-14(21(19)31-23(15)29)8-9-24(4,5)32-16/h11-12,20H,7-10H2,1-6H3,(H,25,26)(H,27,28)
InChIKey QQTUUZPXDXTEBZ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_6075
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: F26862; Labnumber: ExGar-018109