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(5S,5S)-N(1),N(10)-BIS-[3-O-BENZYL-5-CARBETHOXYMETHYL-5-DEOXY-1,2-O-ISOPROPYLIDENE-ALPHA-D-XYLOFURANOS-5-YL]-1,10-DIAMINODECANE
SpectraBase Compound ID KsO4RcpXvLH
InChI InChI=1S/C48H72N2O12/c1-7-53-37(51)29-35(39-41(55-31-33-23-17-15-18-24-33)43-45(57-39)61-47(3,4)59-43)49-27-21-13-11-9-10-12-14-22-28-50-36(30-38(52)54-8-2)40-42(56-32-34-25-19-16-20-26-34)44-46(58-40)62-48(5,6)60-44/h15-20,23-26,35-36,39-46,49-50H,7-14,21-22,27-32H2,1-6H3/t35-,36-,39-,40+,41+,42-,43-,44+,45-,46+/m0/s1
InChIKey AEWBNUBRTLENMH-QBUOHYIPSA-N
Mol Weight 869.1 g/mol
Molecular Formula C48H72N2O12
Exact Mass 868.508526 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I9NrNIogNYl
Name (5S,5S)-N(1),N(10)-BIS-[3-O-BENZYL-5-CARBETHOXYMETHYL-5-DEOXY-1,2-O-ISOPROPYLIDENE-ALPHA-D-XYLOFURANOS-5-YL]-1,10-DIAMINODECANE
Compound Number 17B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H72N2O12
InChI InChI=1S/C48H72N2O12/c1-7-53-37(51)29-35(39-41(55-31-33-23-17-15-18-24-33)43-45(57-39)61-47(3,4)59-43)49-27-21-13-11-9-10-12-14-22-28-50-36(30-38(52)54-8-2)40-42(56-32-34-25-19-16-20-26-34)44-46(58-40)62-48(5,6)60-44/h15-20,23-26,35-36,39-46,49-50H,7-14,21-22,27-32H2,1-6H3/t35-,36-,39-,40+,41+,42-,43-,44+,45-,46+/m0/s1
InChIKey AEWBNUBRTLENMH-QBUOHYIPSA-N
Literature Reference Author V.K.TIWARI,N.TEWARI,D.KATIYAR,R.P.TRIPATHI,K.ARORA,S.GUPTA,R .AHMAD,A.K.SRIVASTAV
Literature Reference Citation BIOORG.MED.CHEM.,11,1789(2003)
Literature Reference DOI 10.1016/S0968-0896(03)00033-6
Molecular Weight 869.106 g/mol
Sample ID 29140
Solvent CDCl3