Gibboside
TL;DR: Gibboside (CAS 108906-56-5) is a chemical compound with molecular formula C16H26O9 and molecular weight 362.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,4aS,6S,7S,7aS)-7-(hydroxymethyl)-4-methyl-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyran-3-one
Also Known As: Gibboside, (-)-Gibboside, J1.821.923I, (4R,4aS,6S,7S,7aS)-7-(hydroxymethyl)-4-methyl-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyran-3-one, (4R,4aalpha,7aalpha)-4alpha-Methyl-6alpha-(beta-D-glucopyranosyloxy)-7alpha-(hydroxymethyl)octahydrocyclopenta[c]pyran-3-one
| Molecular Formula | C16H26O9 |
|---|---|
| Molecular Weight | 362.16 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.15768 |
| Heavy Atoms | 25 |
| Complexity | 486.0 |
Chemical Identifiers
| CAS Number | 108906-56-5 |
|---|---|
| SMILES | C[C@@H]1[C@H]2C[C@@H]([C@@H]([C@H]2COC1=O)CO)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O |
| InChIKey | RAKWYUWXLTYDQR-LTPIHACHSA-N |
Product Overview
Gibboside (CAS 108906-56-5), with molecular formula C16H26O9 and molecular weight 362.16 g/mol. IUPAC: (4R,4aS,6S,7S,7aS)-7-(hydroxymethyl)-4-methyl-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyran-3-one.
Chemical Property Profile of Gibboside
Property Insights of Gibboside
The XLogP value of -1.6 indicates that Gibboside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 146.0 Ų indicates high polarity, suggesting Gibboside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Gibboside has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Gibboside?
The CAS number of Gibboside is 108906-56-5.
What is the molecular formula of Gibboside?
The molecular formula of Gibboside is C16H26O9.
What is the molecular weight of Gibboside?
The molecular weight of Gibboside is 362.16 g/mol.
Where can I buy Gibboside?
You can request a quote for Gibboside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Gibboside?
Yes, KEHONG BIO provides custom synthesis services for Gibboside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.