Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside
TL;DR: Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside (CAS 131289-51-5) is a chemical compound with molecular formula C21H38O18 and molecular weight 578.2058 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5S,6R)-6-[(1R)-1,2-dihydroxyethyl]-3-[(2S,3S,4S,5S,6R)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2,5-dihydroxy-2-methyloxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: MGHPH, Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside, (2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5S,6R)-6-[(1R)-1,2-dihydroxyethyl]-3-[(2S,3S,4S,5S,6R)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2,5-dihydroxy-2-methyloxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol, Methyl-3-O-(alpha-D-glucopyranosyl)-7-O-(L-glycero-alpha-D-manno-heptopyranosyl)-L-glycero-alpha-D-manno-heptopyranoside, (2R,3R,4S,5S,6S)-2-[(1R)-1,2-dihydroxyethyl]-6-[(2R,3S,4S,5S,6R)-6-[(1 R)-1,2-dihydroxyethyl]-2,5-di
Technical Specifications
| Molecular Formula | C21H38O18 |
| Molecular Weight | 578.2058 g/mol |
| XLogP | -6.8 |
| Topological Polar Surface Area (TPSA) | 309.0 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 9 |
| Exact Mass | 578.2058 Da |
| Heavy Atoms | 39 |
| Complexity | 777.0 |
| SMILES | C[C@@]1([C@H]([C@H]([C@@H]([C@H](O1)[C@@H](CO)O)O)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O[C@H]3[C@H]([C@H]([C@@H]([C@H](O3)[C@@H](CO)O)O)O)O)O |
| InChIKey | YZEOCOYTQXUPSU-JARXOOGZSA-N |
Chemical Property Profile of Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside
Property Insights of Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside
The XLogP value of -6.8 indicates that Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 309.0 Ų indicates high polarity, suggesting Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside has 13 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside?
The CAS number of Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside is 131289-51-5.
What is the molecular formula of Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside?
The molecular formula of Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside is C21H38O18.
What is the molecular weight of Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside?
The molecular weight of Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside is 578.2058 g/mol.
Where can I buy Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside?
You can request a quote for Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside?
Yes, CoreyChem provides custom synthesis services for Methyl 3-O-glucopyranosyl-7-O-heptopyranosyl-heptopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.