| CAS Number | 19817-88-0 |
| Catalog Number | AG002BCC(AGN-PC-0O6SQ9) |
| Chemical Name | D-Glucose, 2-deoxy-2-[(1-oxohexyl)amino]- |
| IUPAC Name | N-[(2R,3R,4S,5R)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]hexanamide |
| InChI | InChI=1S/C12H23NO6/c1-2-3-4-5-10(17)13-8(6-14)11(18)12(19)9(16)7-15/h6,8-9,11-12,15-16,18-19H,2-5,7H2,1H3,(H,13,17)/t8-,9+,11+,12+/m0/s1 |
| InChI Key | QLZZYPWIRVQENX-LUTQBAROSA-N |
| MDL Number | MFCD00059806 |
| Molecular Formula | C12H23NO6 |
| Molecular Weight | 277.3141 |
| SMILES | O[C@@H]([C@@H]([C@@H](CO)O)O)[C@@H](NC(CCCCC)=O)C=O |
| Synonyms | 19817-88-0,
N-((2R,3R,4S,5R)-3,4,5,6-Tetrahydroxy-1-oxohexan-2-yl)hexanamide,
N-Caproyl-D-glucosamine,
SCHEMBL5157353,
CTK4E2433,
2-Desoxy-2-hexanoylamino-D-glucose,
ANW-23806,
TC-112551,
FT-0773145,
KS-00001537,
13996-79-7,
N-Hexanoyl-D-glucosamine,
QLZZYPWIRVQENX-LUTQBAROSA-N,
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| Complexity | 273 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 4 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 277.153g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 5 |
| Isotope Atom Count | 0 |
| Molecular Weight | 277.317g/mol |
| Monoisotopic Mass | 277.153g/mol |
| Rotatable Bond Count | 10 |
| Topological Polar Surface Area | 127A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number