| CAS Number | 383905-60-0 |
| Catalog Number | AG003LOF(AGN-PC-0RGEEH) |
| Chemical Name | 4-Methoxyphenyl 3-O-Benzyl-beta-D-galactopyranoside |
| IUPAC Name | (2S,3S,4S,5S,6S)-2-(hydroxymethyl)-6-(4-methoxyphenoxy)-4-phenylmethoxyoxane-3,5-diol |
| InChI | InChI=1S/C20H24O7/c1-24-14-7-9-15(10-8-14)26-20-18(23)19(17(22)16(11-21)27-20)25-12-13-5-3-2-4-6-13/h2-10,16-23H,11-12H2,1H3/t16-,17-,18-,19-,20+/m0/s1 |
| InChI Key | CZPFTCBIXZWFIZ-VYJAJWGXSA-N |
| MDL Number | MFCD11112174 |
| Molecular Formula | C20H24O7 |
| Molecular Weight | 376.4004 |
| SMILES | O[C@H]([C@H]([C@H]([C@@H](CO)O1)O)OCC2=CC=CC=C2)[C@@H]1OC3=CC=C(OC)C=C3 |
| Synonyms | 4-Methoxyphenyl 3-O-Benzyl-beta-D-galactopyranoside,
383905-60-0,
DTXSID60693679,
MFCD11112174,
M1725,
4-Methoxyphenyl 3-O-benzyl-alpha-L-allopyranoside,
|
| Complexity | 421 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 5 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 376.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 27 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 376.405g/mol |
| Monoisotopic Mass | 376.152g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 97.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number