| CAS Number | 40762-22-9 |
| Catalog Number | AG003PA5(AGN-PC-0RP2XC) |
| Chemical Name | D-Glucose-1-13C |
| IUPAC Name | (3R,4S,5S,6R)-6-(hydroxymethyl)(213C)oxane-2,3,4,5-tetrol |
| InChI | InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6?/m1/s1/i6+1 |
| InChI Key | WQZGKKKJIJFFOK-USBRANDWSA-N |
| MDL Number | MFCD00037545 |
| Molecular Formula | C6H12O6 |
| Molecular Weight | 181.1485 |
| SMILES | [C@@H](O)([C@H](O)CO)[C@H](O)[C@@H](O)[13CH]=O |
| Synonyms | D-Glucose-1-13C,
40762-22-9,
Dextrose-1-13C,
D-[1-13C]glucose,
Omicron GLC-018,
BICL4105,
SCHEMBL6038231,
DTXSID90484451,
D-(+)-Glucose-1-(13C),
ZX-AFC001540,
D-Glucose-1-13C, 99 atom % 13C,
FT-0694932,
C-46788,
D-Glucose-1-13C min. Chem. 99% min. Isot. 99%,
D-Glucose-1-13C, S & P tested, 99 atom % 13C,
Labeled Glucose,
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| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 4 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 5 |
| Isotope Atom Count | 1 |
| Molecular Weight | 181.148g/mol |
| Monoisotopic Mass | 181.067g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 110A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -2.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number