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1,8-DI-O-HEXYL-15-O-TOSYL-ALOE-EMODIN

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1,8-DI-O-HEXYL-15-O-TOSYL-ALOE-EMODIN
SpectraBase Compound ID 35wCw1mHYXj
InChI InChI=1S/C34H40O7S/c1-4-6-8-10-19-39-29-14-12-13-27-31(29)34(36)32-28(33(27)35)21-25(22-30(32)40-20-11-9-7-5-2)23-41-42(37,38)26-17-15-24(3)16-18-26/h12-18,21-22H,4-11,19-20,23H2,1-3H3
InChIKey UCFRTRBCMVRIDK-UHFFFAOYSA-N
Mol Weight 592.7 g/mol
Molecular Formula C34H40O7S
Exact Mass 592.249475 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4casn6rKiv4
Name 1,8-DI-O-HEXYL-15-O-TOSYL-ALOE-EMODIN
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H40O7S
InChI InChI=1S/C34H40O7S/c1-4-6-8-10-19-39-29-14-12-13-27-31(29)34(36)32-28(33(27)35)21-25(22-30(32)40-20-11-9-7-5-2)23-41-42(37,38)26-17-15-24(3)16-18-26/h12-18,21-22H,4-11,19-20,23H2,1-3H3
InChIKey UCFRTRBCMVRIDK-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 592.747 g/mol
Sample ID 1505
Solvent CDCl3