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[4A-S-(4A-ALPHA,5-BETA,6-ALPHA,7A-ALPHA,7B-BETA)]-5-ACETYLOXY-6-ACETYLOXYMETHYL-5,6,7A,7B-TETRAHYDRO-2H-1,7-DIOXACYCLOPENT-[CD]-INDEN-4-(4A-H)-ONE

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

[4A-S-(4A-ALPHA,5-BETA,6-ALPHA,7A-ALPHA,7B-BETA)]-5-ACETYLOXY-6-ACETYLOXYMETHYL-5,6,7A,7B-TETRAHYDRO-2H-1,7-DIOXACYCLOPENT-[CD]-INDEN-4-(4A-H)-ONE
SpectraBase Compound ID 9rlCs6DS8je
InChI InChI=1S/C14H16O7/c1-6(15)18-5-10-13(20-7(2)16)12-9(17)3-8-4-19-14(21-10)11(8)12/h3,10-14H,4-5H2,1-2H3/t10-,11-,12+,13-,14+/m1/s1
InChIKey MOONENKAIYEQFX-RGDJUOJXSA-N
Mol Weight 296.28 g/mol
Molecular Formula C14H16O7
Exact Mass 296.089603 g/mol
Enantiomer InChIKey MOONENKAIYEQFX-PDWCTOEPSA-N

View Spectrum of [4A-S-(4A-ALPHA,5-BETA,6-ALPHA,7A-ALPHA,7B-BETA)]-5-ACETYLOXY-6-ACETYLOXYMETHYL-5,6,7A,7B-TETRAHYDRO-2H-1,7-DIOXACYCLOPENT-[CD]-INDEN-4-(4A-H)-ONE

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum J-64-8308-2

View Spectrum of [4A-S-(4A-ALPHA,5-BETA,6-ALPHA,7A-ALPHA,7B-BETA)]-5-ACETYLOXY-6-ACETYLOXYMETHYL-5,6,7A,7B-TETRAHYDRO-2H-1,7-DIOXACYCLOPENT-[CD]-INDEN-4-(4A-H)-ONE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • [4aS-(4a.alpha.,5.beta.,6.alpha.,7a.alpha.,7b.alpha.)]-5-(Acetyloxy)-6-[(acetyloxy)methyl]-5,6,7a,7b-tetrahydro-2H-1,7-dioxacyclopent[cd]inden-4(4aH)-one
#18;[4A-S-(4A-ALPHA,5-BETA,6-ALPHA,7A-ALPHA,7B-ALPHA)]-5-BENZYLOXY-6-[(BENZYLOXY)-METHYL]-5,6,7A,7B-TETRAHYDRO-2H-1,7-DIOXACYCLOPENT-[CD]-INDEN-4-(4A-H)-ONE
FNMVQMQYYQSYSA-GMKBEQEGSA-N
GOVOQSAEPMURAD-UHFFFAOYSA-N
1,3,4,6-TETRA-O-ACETYL-2-O-(2,3,4,6-TETRA-O-BENZOYL-alpha-D-MANNOPYRANOSYL)-beta-D-MANNOPYRANOSE
OKANIN-4'-O-BETA-D-(3'',4'',6''-TRIACETYL)-GLUCOPYRANOSIDE
3,4,6-TRI-O-ACETYL-2-DEOXY-2-(2,5-DIMETHYLPYRROL-1-YL)-BETA-D-GLUCOPYRANOSYL-TRICHLOROACETIMIDATE
4a(R),4b(R),5(R),5a(S),9a(S),10a(S),11a(S)-7,7-Dimethyl-1,4,4a,5,5a,9,9a,10a,11a-octahydro-6,8,10,11-tetraoxabenzo[b]fluoren-5-yl benzyl ether
VERBACOSIDE-PENTAACETATE
DEC-9-ENYL-2,3,6-TRI-O-BENZOYL-4-O-(2,3,4,6-TETRA-O-ACETYL-alpha-D-GALAKTOPYRANOSYL)-alpha-D-MANNOPYRANOSE
BLUMEOSIDE-A
Title Journal or Book Year
Iridoids from Carbohydrates via Pauson−Khand Reaction:  Synthesis of Advanced Highly Oxygenated Cyclopentane-Annulated Pyranosides from d-Glucal Derivatives The Journal of Organic Chemistry 1999
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