Debug Info

object
{15}
_id
:
9yULL1fihJL
spectrumID
:
9yULL1fihJL
cost
:
1
specType
:
262144
xnmrNucleus
:
0
dbLocation
:
WRX:96137:1
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
THIAZINOTRIENOMYCIN-G
SpectraBase Compound ID 6kxSFqWht02
InChI InChI=1S/C37H49N3O7S/c1-23-14-13-18-28-34(43)29(21-30-35(28)48-22-38-30)40-32(41)20-27(46-4)17-11-6-5-7-12-19-31(24(2)33(23)42)47-37(45)25(3)39-36(44)26-15-9-8-10-16-26/h5-7,11-12,14,17,21-22,24-27,31,33,42-43H,8-10,13,15-16,18-20H2,1-4H3,(H,39,44)(H,40,41)/b6-5+,12-7+,17-11+,23-14-
InChIKey XWXHOGFLJKTTBA-MHVOAVBDSA-N
Mol Weight 679.9 g/mol
Molecular Formula C37H49N3O7S
Exact Mass 679.329122 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 9yULL1fihJL
Name THIAZINOTRIENOMYCIN-G
Compound Number 2
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H49N3O7S
InChI InChI=1S/C37H49N3O7S/c1-23-14-13-18-28-34(43)29(21-30-35(28)48-22-38-30)40-32(41)20-27(46-4)17-11-6-5-7-12-19-31(24(2)33(23)42)47-37(45)25(3)39-36(44)26-15-9-8-10-16-26/h5-7,11-12,14,17,21-22,24-27,31,33,42-43H,8-10,13,15-16,18-20H2,1-4H3,(H,39,44)(H,40,41)/b6-5+,12-7+,17-11+,23-14-
InChIKey XWXHOGFLJKTTBA-MHVOAVBDSA-N
Literature Reference Author N.HOSOKAWA,H.NAGANAWA,M.HAMADA,H.IINUMA,T.TAKEUCHI,K.S.TSUCH IYA,M.HORI
Literature Reference Citation J.ANTIBIOTICS,53,886(2000)
Literature Reference DOI 10.7164/antibiotics.53.886
Molecular Weight 679.872 g/mol
Solvent PYRIDINE-D5
Source File Reference UWRU7248
ADVERTISEMENT