Debug Info

object
{15}
_id
:
6b5NdNEWtzs
spectrumID
:
6b5NdNEWtzs
cost
:
1
specType
:
262144
xnmrNucleus
:
0
dbLocation
:
WRX:274306:1
hasStructureAssignments
:
true
properties
{12}
analyticalTechnique
:
13C NMR
analyticalTechniqueLongName
:
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
isFullSpectrum
:
false
spectralOutlier
:
false
compound
{10}
lastUpdated
:
1735074081058
isDeprecated
:
false

Logged In :

Authorized Features

  • None
  • DataFullSpectraPoints
  • DataReadAll
  • DataReportGeneration
  • ExportCompound
  • ExportStructure
  • ExportSpectrum
  • ImageFullMS
  • ImageHighRes
  • ImageFullAxis
  • SearchSpectral
  • SearchStructure
ADVERTISEMENT
[(2-R,3-R,4-S,5-S)-2-(3',4'-METHYLENEDIOXY)-PHENYL-3,6-DIHYDROXY-4,5-ISOPROPYLIDENEDIOXY]-HEXYL_BENZAMIDE
SpectraBase Compound ID AIlBWCEFsuG
InChI InChI=1S/C23H27NO7/c1-23(2)30-19(12-25)21(31-23)20(26)16(11-24-22(27)14-6-4-3-5-7-14)15-8-9-17-18(10-15)29-13-28-17/h3-10,16,19-21,25-26H,11-13H2,1-2H3,(H,24,27)/t16-,19+,20+,21-/m0/s1
InChIKey PXYDRJKRQNAJGC-ZXNZYJFHSA-N
Mol Weight 429.47 g/mol
Molecular Formula C23H27NO7
Exact Mass 429.178752 g/mol
ADVERTISEMENT

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 6b5NdNEWtzs
Name [(2-R,3-R,4-S,5-S)-2-(3',4'-METHYLENEDIOXY)-PHENYL-3,6-DIHYDROXY-4,5-ISOPROPYLIDENEDIOXY]-HEXYL_BENZAMIDE
Compound Number 25
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H27NO7
InChI InChI=1S/C23H27NO7/c1-23(2)30-19(12-25)21(31-23)20(26)16(11-24-22(27)14-6-4-3-5-7-14)15-8-9-17-18(10-15)29-13-28-17/h3-10,16,19-21,25-26H,11-13H2,1-2H3,(H,24,27)/t16-,19+,20+,21-/m0/s1
InChIKey PXYDRJKRQNAJGC-ZXNZYJFHSA-N
Literature Reference Author J.MCNULTY,J.J.NAIR,C.GRIFFIN,S.PANDEV
Literature Reference Citation J.NAT.PROD.,71,357(2008)
Literature Reference DOI 10.1021/np0705460
Molecular Weight 429.470 g/mol
Sample ID 27502
Solvent CDCl3
ADVERTISEMENT