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1,8-DI-O-HEXYL-ALOE-EMODIN
SpectraBase Compound ID HI6JCHxghvi
InChI InChI=1S/C27H34O5/c1-3-5-7-9-14-31-22-13-11-12-20-24(22)27(30)25-21(26(20)29)16-19(18-28)17-23(25)32-15-10-8-6-4-2/h11-13,16-17,28H,3-10,14-15,18H2,1-2H3
InChIKey ULFWSXBQWSZLDU-UHFFFAOYSA-N
Mol Weight 438.6 g/mol
Molecular Formula C27H34O5
Exact Mass 438.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ANntoxUYdmx
Name 1,8-DI-O-HEXYL-ALOE-EMODIN
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H34O5
InChI InChI=1S/C27H34O5/c1-3-5-7-9-14-31-22-13-11-12-20-24(22)27(30)25-21(26(20)29)16-19(18-28)17-23(25)32-15-10-8-6-4-2/h11-13,16-17,28H,3-10,14-15,18H2,1-2H3
InChIKey ULFWSXBQWSZLDU-UHFFFAOYSA-N
Literature Reference Author X.R.CUI,K.TAKAHASHI,T.SHIMAMURA,J.KOYANAGI,F.KOMADA,S.SAITO
Literature Reference Citation CHEM.PHARM.BULL.,56,497(2008)
Literature Reference DOI 10.1248/cpb.56.497
Molecular Weight 438.564 g/mol
Sample ID 1497
Solvent CDCl3