For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Aloin A

Compound with spectra: 1 NMR, and 3 MS (GC)

Aloin A
SpectraBase Compound ID FAwTRkrBSAu
InChI InChI=1S/C21H22O9/c22-6-8-4-10-14(21-20(29)19(28)17(26)13(7-23)30-21)9-2-1-3-11(24)15(9)18(27)16(10)12(25)5-8/h1-5,13-14,17,19-26,28-29H,6-7H2/t13-,14-,17-,19+,20-,21+/m1/s1
InChIKey AFHJQYHRLPMKHU-WEZNYRQKSA-N
Mol Weight 418.4 g/mol
Molecular Formula C21H22O9
Exact Mass 418.126382 g/mol
Enantiomer InChIKey AFHJQYHRLPMKHU-WXEBUNRTSA-N

View Spectrum of Aloin A

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum CD-597-0-0

View Spectrum of Aloin A

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum KO-6-379-10

View Spectrum of Aloin A

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum CJ-0-14-0

View Spectrum of Aloin A

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
  • (10R)-1,8-dihydroxy-3-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]-10H-anthracen-9-one
Aloin A
Aloin
(10R,1'S)-ALOIN-B
MICRODONTIN-A
PICRAMNIOSIDE-B
ALVARADOIN_F;(10-R)-C-(1-O-ACETYL)-BETA-L-LYXOPYRANOSYL-1,8-DIHYDROXY-3-METHYLANTHRACEN-9-(10-H)-ONE
10-EPI-UVEOSIDE
ALVARADOIN_M;(10-S)-C-(3-O-SENECIOYL)-BETA-L-LYXOPYRANOSYL-1,8-DIHYDROXY-3-METHYLANTHRACEN-9-(10-H)-ONE
ALVARADOIN_K;(10-R)-C-(2-O-SENECIOYL)-BETA-D-LYXOPYRANOSYL-1,8-DIHYDROXY-3-METHYLANTHRACEN-9-(10-H)-ONE
ALVARADOIN_L;(10-S)-C-(2-O-SENECIOYL)-BETA-L-LYXOPYRANOSYL-1,8-DIHYDROXY-3-METHYLANTHRACEN-9-(10-H)-ONE
(10S)-10-C-(4-O-BENZOYL-ALPHA-ARABINOPYRANOSYL)-1,8-DIHYDROXY-3-METHYLANTHRACEN-9(10H)-ONE
(10R)-10-C-(4-O-BENZOYL-ALPHA-ARABINOPYRANOSYL)-1,8-DIHYDROXY-3-METHYLANTHRACEN-9(10H)-ONE
Title Journal or Book Year
Conformational studies of natural products. Part 4. Conformation and absolute configuration of cascarosides A, B, C, D Journal of the Chemical Society, Perkin Transactions 1 1993
Aloin A
(10R,1'S)-ALOIN-B
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.