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Methyl (3R,4S,5R)-3,4,5-Trihydroxycyclohex-1-ene-1-carboxylate

Compound with spectra: 2 NMR, and 1 MS (GC)

Methyl (3R,4S,5R)-3,4,5-Trihydroxycyclohex-1-ene-1-carboxylate
SpectraBase Compound ID 2cKgVksn66v
InChI InChI=1S/C8H12O5/c1-13-8(12)4-2-5(9)7(11)6(10)3-4/h2,5-7,9-11H,3H2,1H3/t5-,6-,7-/m1/s1
InChIKey LSNUUAUXWJZSFD-FSDSQADBSA-N
Mol Weight 188.18 g/mol
Molecular Formula C8H12O5
Exact Mass 188.068473 g/mol
Enantiomer InChIKey LSNUUAUXWJZSFD-ACZMJKKPSA-N

View Spectrum of Methyl (3R,4S,5R)-3,4,5-Trihydroxycyclohex-1-ene-1-carboxylate

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum H-74-813-9

View Spectrum of Methyl (3R,4S,5R)-3,4,5-Trihydroxycyclohex-1-ene-1-carboxylate

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown

View Spectrum of Methyl (3R,4S,5R)-3,4,5-Trihydroxycyclohex-1-ene-1-carboxylate

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
  • METHYL-(-)-SHIKIMATE
(-)-Methyl 5-epi-shikimate
(3S,4S,5R)-3,4,5-TRIHYDROXY-1-CYClOHEXENE-CARBOXYLIC-ACID-METHYLESTER
3,4,5-TRIHYDROXY-1-CYCLOHEXENE-1-CARBOXYLIC ACID, METHYL ESTER
Gabosine C
Gabosine E
(4R,5R,6R)-2-(hydroxymethyl)-4,5,6-tris(oxidanyl)cyclohex-2-en-1-one
GARDNERILIN-A
VENEZENIN
Methyl 8-oxabicyclo[5.1.0]oct-2-ene-2-carboxylate
2-[2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxy-ethyl]acrylic acid methyl ester
Title Journal or Book Year
Synthesis of (-)-shikimate and (-)-quinate 3-phosphates by differentiation of the hydroxyl functions of (-)-shikimic and (-)-quinic acids The Journal of Organic Chemistry 1992
Studies Directed Towards the Biosynthesis of the C7N Unit of Rifamycin B: A New Synthesis of Quinic Acid from Shikimic Acid Helvetica Chimica Acta 1991

Wiley Registry of Mass Spectral Data 12th Edition
Author: Wiley

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