| CAS Number | 41308-76-3 |
| Catalog Number | AG00C7ZW(AGN-PC-0RQDY7) |
| Chemical Name | Allyl alpha-d-mannopyranoside |
| IUPAC Name | (2R,3S,4S,5S,6S)-2-(hydroxymethyl)-6-prop-2-enoxyoxane-3,4,5-triol |
| InChI | InChI=1S/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6-,7+,8+,9+/m1/s1 |
| InChI Key | XJNKZTHFPGIJNS-DFTQBPQZSA-N |
| MDL Number | MFCD08274515 |
| Molecular Formula | C9H16O6 |
| Molecular Weight | 220.2197 |
| SMILES | C=CCO[C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O |
| Synonyms | Allyl alpha-D-mannopyranoside,
allyl-alpha-d-mannopyranoside,
41308-76-3,
allyl a-d-mannopyranoside,
SCHEMBL118226,
CHEMBL3799758,
XJNKZTHFPGIJNS-DFTQBPQZSA-N,
Allyl alpha-D-mannopyranoside, 95%,
MFCD08274515,
ZINC17158816,
AKOS030528203,
Allyl galactopyranoside,
|A-D-Mannopyranoside, 2-propen-1-yl,
CID11183597,
|
| Complexity | 209 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 5 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.221g/mol |
| Monoisotopic Mass | 220.095g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 99.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number