For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

N(1),N(12)-BIS-[5-CARBETHOXYMETHYL-5-DEOXY-1,2-O-ISOPROPYLIDENE-3-O-METHYL-ALPHA-D-XYLOFURANOS-5-YL]-1,12-DIAMINODODECANE

View entire compound with spectra: 1 NMR

N(1),N(12)-BIS-[5-CARBETHOXYMETHYL-5-DEOXY-1,2-O-ISOPROPYLIDENE-3-O-METHYL-ALPHA-D-XYLOFURANOS-5-YL]-1,12-DIAMINODODECANE
SpectraBase Compound ID 2sP4kSD7xda
InChI InChI=1S/C38H68N2O12/c1-9-45-27(41)23-25(29-31(43-7)33-35(47-29)51-37(3,4)49-33)39-21-19-17-15-13-11-12-14-16-18-20-22-40-26(24-28(42)46-10-2)30-32(44-8)34-36(48-30)52-38(5,6)50-34/h25-26,29-36,39-40H,9-24H2,1-8H3/t25-,26-,29-,30+,31+,32-,33-,34+,35-,36+/m0/s1
InChIKey ZOCBTVDUOARQSQ-IOPOZBMRSA-N
Mol Weight 745.0 g/mol
Molecular Formula C38H68N2O12
Exact Mass 744.477226 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7mqVKUcpI5
Name N(1),N(12)-BIS-[5-CARBETHOXYMETHYL-5-DEOXY-1,2-O-ISOPROPYLIDENE-3-O-METHYL-ALPHA-D-XYLOFURANOS-5-YL]-1,12-DIAMINODODECANE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H68N2O12
InChI InChI=1S/C38H68N2O12/c1-9-45-27(41)23-25(29-31(43-7)33-35(47-29)51-37(3,4)49-33)39-21-19-17-15-13-11-12-14-16-18-20-22-40-26(24-28(42)46-10-2)30-32(44-8)34-36(48-30)52-38(5,6)50-34/h25-26,29-36,39-40H,9-24H2,1-8H3/t25-,26-,29-,30+,31+,32-,33-,34+,35-,36+/m0/s1
InChIKey ZOCBTVDUOARQSQ-IOPOZBMRSA-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 744.964 g/mol
Sample ID 29138
Solvent CDCl3