About This Item
InChI
1S/C57H104O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h25-30,54H,4-24,31-53H2,1-3H3/b28-25-,29-26-,30-27-/i1+1,4+1,7+1,10+1,13+1,16+1,19+1,22+1,25+1,28+1,31+1,34+1,37+1,40+1,43+1,46+1,49+1,55+1
SMILES string
CCCCCCCC\C=C/CCCCCCCC(=O)OCC(CO[13C](=O)[13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2]\[13CH]=[13CH]/[13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH3])OC(=O)CCCCCCC\C=C/CCCCCCCC
InChI key
PHYFQTYBJUILEZ-UMEQFEBFSA-N
isotopic purity
99 atom % 13C
assay
97% (CP)
form
liquid
bp
235-240 °C/18 mmHg (lit.)
density
0.93 g/mL (lit.)
mass shift
M+18
storage temp.
−20°C
Related Categories
General description
Application
- Metabolomic profiling and pathway analysis
- Stable Isotope probing in Environmental microbiology
- Pharmaceutical formulation development
Features and Benefits
- Improves the quality of NMR data.
- Enhances understanding of molecular interactions.
- Facilitates the discoveryof new pharmaceuticals.
- Supports high-quality outcomes in research projects.
Benefits
- Enhances the accuracy of metabolic studies.
- Increases efficiency in drug development processes.
- Supports regulatory compliance and safety standards.
- Provides a competitive advantage in the pharmaceutical market.
Packaging
Storage Class
10 - Combustible liquids
wgk
awg
flash_point_f
626.0 °F - closed cup
flash_point_c
330.0 °C - closed cup
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