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7-O-[2,6-DIDEOXY-2-FLUORO-5-C-(TRIFLUOROMETHYL)-ALPHA-L-TALOPYRANOSYL]-ADRIAMYCINONE
SpectraBase Compound ID 7J88HuYmsSM
InChI InChI=1S/C27H26F4O12/c1-41-10-4-2-3-8-13(10)20(36)16-15(18(8)34)19(35)9-5-26(40,12(33)7-32)6-11(14(9)21(16)37)42-25-17(28)22(38)23(39)24(43-25)27(29,30)31/h2-4,11,14-15,17,22-25,32,35,37-40H,5-7H2,1H3/t11-,14?,15?,17-,22+,23+,24-,25-,26-/m0/s1
InChIKey DAQQYINRJDXXTP-IKDKUYLGSA-N
Mol Weight 618.49 g/mol
Molecular Formula C27H26F4O12
Exact Mass 618.136039 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F7cX42j3r2H
Name 7-O-[2,6-DIDEOXY-2-FLUORO-5-C-(TRIFLUOROMETHYL)-ALPHA-L-TALOPYRANOSYL]-ADRIAMYCINONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H26F4O12
InChI InChI=1S/C27H26F4O12/c1-41-10-4-2-3-8-13(10)20(36)16-15(18(8)34)19(35)9-5-26(40,12(33)7-32)6-11(14(9)21(16)37)42-25-17(28)22(38)23(39)24(43-25)27(29,30)31/h2-4,11,14-15,17,22-25,32,35,37-40H,5-7H2,1H3/t11-,14?,15?,17-,22+,23+,24-,25-,26-/m0/s1
InChIKey DAQQYINRJDXXTP-IKDKUYLGSA-N
Literature Reference Author K.NAKAI,Y.TAKAGI,T.TSUCHIYA
Literature Reference Citation CARBOHYDR.RES.,316,47(1999)
Literature Reference DOI 10.1016/S0008-6215(99)00028-2
Molecular Weight 618.490 g/mol
Solvent PYRIDINE-D5