TL;DR: Mimonoside A (CAS 157610-44-1) is a chemical compound with molecular formula C69H112O33 and molecular weight 1468.7086 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,4,5-trihydroxy-6-methyloxan-2-yl) 10-[3-[4-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-3,5-dihydroxy-6-(3,4,5-trihydroxyoxan-2-yl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
Also Known As: Mimonoside A, 6-deoxy-1-o-(3-{[6-deoxyhexopyranosyl-(1-, (3,4,5-trihydroxy-6-methyloxan-2-yl) 10-[3-[4-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-3,5-dihydroxy-6-(3,4,5-trihydroxyoxan-2-yl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate, 3-O-(((alpha-Rhamnopyranosyl(1-2)-beta-glucopyranosyl-(1-3))-(alpha-arabinopyranosyl-(1-4))-beta-xylopyranosyl-(1-2))-(beta-xylopyranosyl-(1-4))-beta-glucopyranosyl)-28-O-alpha-rhamnopyranosyloleanolic acid, 6-deoxy-1-o-(3-{[6-deoxyhexopyranosyl-(1->2)hexopyranosyl-(1->3)-6,10-anhydrodecopyranosyl-(1->2)-[pentopyranosyl-(1->4)]hexopyranosyl]oxy}-28-oxoolean-12-en-28-yl)hexopyranose
| Molecular Formula | C69H112O33 |
| Molecular Weight | 1468.7086 g/mol |
| XLogP | -3.8 |
| Topological Polar Surface Area (TPSA) | 521.0 Ų |
| Hydrogen Bond Donors | 19 |
| Hydrogen Bond Acceptors | 33 |
| Rotatable Bonds | 16 |
| Exact Mass | 1468.7086 Da |
| Heavy Atoms | 102 |
| Complexity | 2920.0 |
| SMILES | CC1C(C(C(C(O1)OC2C(C(C(OC2OC3C(C(OC(C3O)OC4C(C(C(OC4OC5CCC6(C(C5(C)C)CCC7(C6CC=C8C7(CCC9(C8CC(CC9)(C)C)C(=O)OC1C(C(C(C(O1)C)O)O)O)C)C)C)CO)OC1C(C(C(CO1)O)O)O)O)C1C(C(C(CO1)O)O)O)O)CO)O)O)O)O)O |
| InChIKey | WJARUDQQRKPGCR-UHFFFAOYSA-N |
The XLogP value of -3.8 indicates that Mimonoside A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 521.0 Ų indicates high polarity, suggesting Mimonoside A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Mimonoside A has 19 hydrogen bond donor(s) and 33 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Mimonoside A is 157610-44-1.
The molecular formula of Mimonoside A is C69H112O33.
The molecular weight of Mimonoside A is 1468.7086 g/mol.
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