| CAS Number | 172838-30-1 |
| Catalog Number | AG00ADNB(AGN-PC-0O4VVG) |
| Chemical Name | Benzyl 3-amino-3-deoxy-alpha-D-mannopyranoside hydrochloride |
| IUPAC Name | (2R,3S,4S,5S,6S)-4-amino-2-(hydroxymethyl)-6-phenylmethoxyoxane-3,5-diol;hydrochloride |
| InChI | InChI=1S/C13H19NO5.ClH/c14-10-11(16)9(6-15)19-13(12(10)17)18-7-8-4-2-1-3-5-8;/h1-5,9-13,15-17H,6-7,14H2;1H/t9-,10+,11-,12+,13+;/m1./s1 |
| InChI Key | ANOGLYAFSWPUKK-LKEZZVCNSA-N |
| MDL Number | MFCD00797596 |
| Molecular Formula | C13H20ClNO5 |
| Molecular Weight | 305.7546 |
| SMILES | Cl.N[C@H]1[C@H](O)[C@@H](CO)O[C@H](OCc2ccccc2)[C@H]1O |
| Synonyms | BENZYL 3-AMINO-3-DEOXY-ALPHA-D-MANNOPYRANOSIDE HYDROCHLORIDE,
172838-30-1,
SCHEMBL8844185,
OR2251T,
ZX-AT020556,
Benzyl 3-amino-3-deoxy-a-D-mannopyranoside HCl,
benzyl 3-amino-3-deoxy-a-D-mannopyranoside hydrochloride,
|
| Complexity | 272 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 5 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 305.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 5 |
| Isotope Atom Count | 0 |
| Molecular Weight | 305.755g/mol |
| Monoisotopic Mass | 305.103g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 105A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number