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METHYL-7,8,9-TRI-O-ACETYL-2,6-ANHYDRO-4-O-(4-CHLOROPHENYL)-3,5-DIDEOXY-5-[(TRIFLUOROACETYL)-AMINO]-D-GLYCERO-D-TALO-NON-2-ENOATE
SpectraBase Compound ID 4TOGMT9nbA3
InChI InChI=1S/C24H25ClF3NO11/c1-11(30)36-10-18(37-12(2)31)20(38-13(3)32)21-19(29-23(34)24(26,27)28)16(9-17(40-21)22(33)35-4)39-15-7-5-14(25)6-8-15/h5-9,16,18-21H,10H2,1-4H3,(H,29,34)/t16-,18+,19-,20-,21-/m1/s1
InChIKey YQORPCDYHWGFCR-RSRIQPTJSA-N
Mol Weight 595.91 g/mol
Molecular Formula C24H25ClF3NO11
Exact Mass 595.106823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2OkDoCX1ODA
Name METHYL-7,8,9-TRI-O-ACETYL-2,6-ANHYDRO-4-O-(4-CHLOROPHENYL)-3,5-DIDEOXY-5-[(TRIFLUOROACETYL)-AMINO]-D-GLYCERO-D-TALO-NON-2-ENOATE
Compound Number 18B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H25ClF3NO11
InChI InChI=1S/C24H25ClF3NO11/c1-11(30)36-10-18(37-12(2)31)20(38-13(3)32)21-19(29-23(34)24(26,27)28)16(9-17(40-21)22(33)35-4)39-15-7-5-14(25)6-8-15/h5-9,16,18-21H,10H2,1-4H3,(H,29,34)/t16-,18+,19-,20-,21-/m1/s1
InChIKey YQORPCDYHWGFCR-RSRIQPTJSA-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 595.911 g/mol
Solvent CDCl3
Source File Reference UWBT18432