TL;DR: MBIP (CAS 146863-04-9) is a chemical compound with molecular formula C14H18O6 and molecular weight 282.11035 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,4aR,6R,7S,8S,8aS)-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine-7,8-diol
Also Known As: MBIP, Methyl 4,6-O-benzylidene-D-altropyranoside, J1.525.365G, Methyl 4-O,6-O-[(R)-benzylidene]-beta-D-altropyranoside, (2R,4aR,6R,7S,8S,8aS)-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine-7,8-diol
| Molecular Formula | C14H18O6 |
| Molecular Weight | 282.11035 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 77.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.11035 Da |
| Heavy Atoms | 20 |
| Complexity | 319.0 |
| SMILES | CO[C@H]1[C@H]([C@@H]([C@H]2[C@H](O1)CO[C@H](O2)C3=CC=CC=C3)O)O |
| InChIKey | VVSWDMJYIDBTMV-GSZZWUTPSA-N |
The XLogP value of -0.1 indicates that MBIP is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for MBIP. Following Lipinski's Rule of Five, MBIP has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of MBIP is 146863-04-9.
The molecular formula of MBIP is C14H18O6.
The molecular weight of MBIP is 282.11035 g/mol.
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