4-甲氧基苯基-3,4-O-異亞丙基-2,6-雙-O-(4-甲基苯甲酰)-β-D-吡喃半乳糖苷 ,
4-Methoxyphenyl 3,4-O-isopropylidene-2,6-bis-O-(4-methylbenzoyl)-β-D-galactopyranoside ,
CAS:1496536-69-6
MDL No.:MFCD06797137
M.F.:C32H34O9
M.W.:562.61
4-Methoxyphenyl 3,4-O-isopropylidene-2,6-bis-O-(4-methylbenzoyl)-β-D-galactopyranoside,
4-Methoxyphenyl 3,4-O-Isopropylidene-2,6-bis-O-(4-methylbenzoyl)-b-D-galactopyranoside is a galactoside that acts as an inhibitor of calcium ion influx. It inhibits actin filament assembly and expression by binding to the N terminus of proteins in the actin filament regulatory complex. 4MPBIG has been shown to have anti-cancer effects through microstructural changes in cancer cells. This compound also inhibits cation channels and prevents the release of neurotransmitters from nerve cells. 4MPBIG has strong thermodynamic and kinetic profiles that can be used for profiling and identification purposes. The irreversible oxidation of the hydroxy group at C2 is a sequence specific process that can be used for identification purposes. The kinase domain contains carbides, which are useful for sequencing purposes due to their stability under acidic conditions.
| CAS Number | 1496536-69-6 |
| Product Name | 4-Methoxyphenyl 3,4-O-Isopropylidene-2,6-bis-O-(4-methylbenzoyl)-beta-D-galactopyranoside |
| IUPAC Name | [(3aS,4R,6S,7R,7aS)-6-(4-methoxyphenoxy)-2,2-dimethyl-7-(4-methylbenzoyl)oxy-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-4-yl]methyl 4-methylbenzoate |
| Molecular Formula | C32H34O9 |
| Molecular Weight | 562.61 g/mol |
| InChI | InChI=1S/C32H34O9/c1-19-6-10-21(11-7-19)29(33)36-18-25-26-27(41-32(3,4)40-26)28(39-30(34)22-12-8-20(2)9-13-22)31(38-25)37-24-16-14-23(35-5)15-17-24/h6-17,25-28,31H,18H2,1-5H3/t25-,26+,27+,28-,31-/m1/s1 |
| InChI Key | BIJBLFRQSLTKJV-ITKRTVBJSA-N |
| SMILES | CC1=CC=C(C=C1)C(=O)OCC2C3C(C(C(O2)OC4=CC=C(C=C4)OC)OC(=O)C5=CC=C(C=C5)C)OC(O3)(C)C |
| Canonical SMILES | CC1=CC=C(C=C1)C(=O)OCC2C3C(C(C(O2)OC4=CC=C(C=C4)OC)OC(=O)C5=CC=C(C=C5)C)OC(O3)(C)C |
| Isomeric SMILES | CC1=CC=C(C=C1)C(=O)OC[C@@H]2[C@H]3[C@@H]([C@H]([C@@H](O2)OC4=CC=C(C=C4)OC)OC(=O)C5=CC=C(C=C5)C)OC(O3)(C)C |
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