Columbianetin glucopyranoside
TL;DR: Columbianetin glucopyranoside (CAS 55836-35-6) is a chemical compound with molecular formula C20H24O9 and molecular weight 408.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-8,9-dihydrofuro[2,3-h]chromen-2-one
Also Known As: Columbianetin glucopyranoside, Columbianetin beta-D-glucopyranoside, (8S)-8-[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-8,9-dihydrofuro[2,3-h]chromen-2-one, 8-[2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-8,9-dihydrofuro[2,3-h]chromen-2-one
| Molecular Formula | C20H24O9 |
|---|---|
| Molecular Weight | 408.14 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 408.14203 |
| Heavy Atoms | 29 |
| Complexity | 650.0 |
Chemical Identifiers
| CAS Number | 55836-35-6 |
|---|---|
| SMILES | CC(C)(C1CC2=C(O1)C=CC3=C2OC(=O)C=C3)OC4C(C(C(C(O4)CO)O)O)O |
| InChIKey | UCJHITBUIWHISE-UHFFFAOYSA-N |
Product Overview
Columbianetin glucopyranoside (CAS 55836-35-6), with molecular formula C20H24O9 and molecular weight 408.14 g/mol. IUPAC: 8-[2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-8,9-dihydrofuro[2,3-h]chromen-2-one.
Chemical Property Profile of Columbianetin glucopyranoside
Property Insights of Columbianetin glucopyranoside
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Columbianetin glucopyranoside. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Columbianetin glucopyranoside. Following Lipinski's Rule of Five, Columbianetin glucopyranoside has 4 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 Columbianetin glucopyranoside?
The CAS number of Columbianetin glucopyranoside is 55836-35-6.
What is the molecular formula of Columbianetin glucopyranoside?
The molecular formula of Columbianetin glucopyranoside is C20H24O9.
What is the molecular weight of Columbianetin glucopyranoside?
The molecular weight of Columbianetin glucopyranoside is 408.14 g/mol.
Where can I buy Columbianetin glucopyranoside?
You can request a quote for Columbianetin glucopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Columbianetin glucopyranoside?
Yes, KEHONG BIO provides custom synthesis services for Columbianetin glucopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.