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METHYL-7,8,9-TRI-O-ACETYL-2,6-ANHYDRO-3,4,5-TRIDEOXY-4-[(METHYL-SULFONYL)-AMINO]-5-[(TRIFLUOROACETYL)-AMINO]-D-GLYCERO-D-TALO-NON-2-ENOATE
SpectraBase Compound ID K1bXGmdLGum
InChI InChI=1S/C19H25F3N2O12S/c1-8(25)33-7-13(34-9(2)26)15(35-10(3)27)16-14(23-18(29)19(20,21)22)11(24-37(5,30)31)6-12(36-16)17(28)32-4/h6,11,13-16,24H,7H2,1-5H3,(H,23,29)/t11-,13+,14-,15-,16-/m1/s1
InChIKey AHPORSMHUBZHNG-DPZJBDQQSA-N
Mol Weight 562.47 g/mol
Molecular Formula C19H25F3N2O12S
Exact Mass 562.10803 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LahOvzM1wnf
Name METHYL-7,8,9-TRI-O-ACETYL-2,6-ANHYDRO-3,4,5-TRIDEOXY-4-[(METHYL-SULFONYL)-AMINO]-5-[(TRIFLUOROACETYL)-AMINO]-D-GLYCERO-D-TALO-NON-2-ENOATE
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H25F3N2O12S
InChI InChI=1S/C19H25F3N2O12S/c1-8(25)33-7-13(34-9(2)26)15(35-10(3)27)16-14(23-18(29)19(20,21)22)11(24-37(5,30)31)6-12(36-16)17(28)32-4/h6,11,13-16,24H,7H2,1-5H3,(H,23,29)/t11-,13+,14-,15-,16-/m1/s1
InChIKey AHPORSMHUBZHNG-DPZJBDQQSA-N
Literature Reference Author P.ALLEVI,P.ROTA,I.S.AGNOLIN,A.GREGORIO,M.ANASTASIA
Literature Reference Citation EUR.J.ORG.CHEM.,2013,4065(2013)
Literature Reference DOI 10.1002/ejoc.201300154
Molecular Weight 562.469 g/mol
Solvent CDCl3
Source File Reference UWBT18421