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#37;2-[5-(4'-AMINO-4'-DEOXY-D-ARABINO-TETRITOL-1'-YL)-2-METHYL-3-FURAMIDE-(N->4')-5-(D-ARABINO-TETRITOL-1'-YL)-2-METHYL-3-FURAMIDE-(N->4')-5-(D-ARABINO-TETRITO
SpectraBase Compound ID 6E5XBxthKqp
InChI InChI=1S/C52H70N6O27/c1-17-22(6-32(81-17)43(71)38(66)27(59)11-53)48(76)54-12-28(60)39(67)44(72)33-7-23(18(2)82-33)49(77)55-13-29(61)40(68)45(73)34-8-24(19(3)83-34)50(78)56-14-30(62)41(69)46(74)35-9-25(20(4)84-35)51(79)57-15-31(63)42(70)47(75)36-10-26(21(5)85-36)52(80)58-16-37(64)65/h6-10,27-31,38-47,59-63,66-75H,11-16,53H2,1-5H3,(H,54,76)(H,55,77)(H,56,78)(H,57,79)(H,58,80)(H,64,65)/t27-,28+,29-,30+,31+,38-,39+,40-,41+,42+,43-,44+,45-,46+,47+/m1/s1
InChIKey MVOBKRLGYGKRRR-YPXMNJNJSA-N
Mol Weight 1211.1 g/mol
Molecular Formula C52H70N6O27
Exact Mass 1210.428891 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IAACcNcMiqy
Name #37;2-[5-(4'-AMINO-4'-DEOXY-D-ARABINO-TETRITOL-1'-YL)-2-METHYL-3-FURAMIDE-(N->4')-5-(D-ARABINO-TETRITOL-1'-YL)-2-METHYL-3-FURAMIDE-(N->4')-5-(D-ARABINO-TETRITO
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H70N6O27
InChI InChI=1S/C52H70N6O27/c1-17-22(6-32(81-17)43(71)38(66)27(59)11-53)48(76)54-12-28(60)39(67)44(72)33-7-23(18(2)82-33)49(77)55-13-29(61)40(68)45(73)34-8-24(19(3)83-34)50(78)56-14-30(62)41(69)46(74)35-9-25(20(4)84-35)51(79)57-15-31(63)42(70)47(75)36-10-26(21(5)85-36)52(80)58-16-37(64)65/h6-10,27-31,38-47,59-63,66-75H,11-16,53H2,1-5H3,(H,54,76)(H,55,77)(H,56,78)(H,57,79)(H,58,80)(H,64,65)/t27-,28+,29-,30+,31+,38-,39+,40-,41+,42+,43-,44+,45-,46+,47+/m1/s1
InChIKey MVOBKRLGYGKRRR-YPXMNJNJSA-N
Literature Reference Author A.J.M.VARGAS,J.J.BARBERO,I.ROBINA
Literature Reference Citation J.ORG.CHEM.,68,4138(2003)
Literature Reference DOI 10.1021/jo026631o
Molecular Weight 1211.152 g/mol
Solvent D2O
Source File Reference UWLU23361