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(3R)-O-BETA-D-GLUCOPYRANOSYLOXY-5-PHENYLVALERIC_ACID_N-BUTYLESTER
SpectraBase Compound ID ImGtcJ3rxYZ
InChI InChI=1S/C21H32O8/c1-2-3-11-27-17(23)12-15(10-9-14-7-5-4-6-8-14)28-21-20(26)19(25)18(24)16(13-22)29-21/h4-8,15-16,18-22,24-26H,2-3,9-13H2,1H3/t15-,16-,18-,19+,20-,21-/m1/s1
InChIKey JJNDFNDBAISVMO-DHKZEPAASA-N
Mol Weight 412.5 g/mol
Molecular Formula C21H32O8
Exact Mass 412.209718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8qXHrK4sT3j
Name (3R)-O-BETA-D-GLUCOPYRANOSYLOXY-5-PHENYLVALERIC_ACID_N-BUTYLESTER
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32O8
InChI InChI=1S/C21H32O8/c1-2-3-11-27-17(23)12-15(10-9-14-7-5-4-6-8-14)28-21-20(26)19(25)18(24)16(13-22)29-21/h4-8,15-16,18-22,24-26H,2-3,9-13H2,1H3/t15-,16-,18-,19+,20-,21-/m1/s1
InChIKey JJNDFNDBAISVMO-DHKZEPAASA-N
Literature Reference Author I.CALIS,A.KURUUEZUEM,L.O.DEMIREZER,O.STICHER,W.GANCI,P.RUEDI
Literature Reference Citation J.NAT.PROD.,62,1101(1999)
Literature Reference DOI 10.1021/np9900674
Molecular Weight 412.480 g/mol
Solvent CD3OD
Source File Reference UWMZ2529