Balanitoside
TL;DR: Balanitoside (CAS 94992-08-2) is a chemical compound with molecular formula C51H84O23 and molecular weight 1064.54 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-hydroxy-6-(hydroxymethyl)-2-[[6-hydroxy-7,9,13-trimethyl-6-[3-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-en-16-yl]oxy]-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
Also Known As: Balanitoside, Protodeltonin, Protodeltonin [M+H]+, (3beta)-26-(beta-D-Glucopyranosyloxy)-22-hydroxyfurost-5-en-3-yl-O-6-deoxy-alphANLG -L-mannopyranosyl-(1-2)-O-(beta-D-glucopyranosyl-(1-4))-beta-D-glucopyranoside, 2-[4-Hydroxy-6-(hydroxymethyl)-2-[[6-hydroxy-7,9,13-trimethyl-6-[3-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-en-16-yl]oxy]-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
| Molecular Formula | C51H84O23 |
|---|---|
| Molecular Weight | 1064.54 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 366.0 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 23 |
| Rotatable Bonds | 15 |
| Exact Mass | 1064.5403 |
| Heavy Atoms | 74 |
| Complexity | 1920.0 |
Chemical Identifiers
| CAS Number | 94992-08-2 |
|---|---|
| SMILES | CC1C2C(CC3C2(CCC4C3CC=C5C4(CCC(C5)OC6C(C(C(C(O6)CO)OC7C(C(C(C(O7)CO)O)O)O)O)OC8C(C(C(C(O8)C)O)O)O)C)C)OC1(CCC(C)COC9C(C(C(C(O9)CO)O)O)O)O |
| InChIKey | RPYHJEFMMXMMHG-UHFFFAOYSA-N |
Product Overview
Balanitoside (CAS 94992-08-2), with molecular formula C51H84O23 and molecular weight 1064.54 g/mol. IUPAC: 2-[4-hydroxy-6-(hydroxymethyl)-2-[[6-hydroxy-7,9,13-trimethyl-6-[3-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-en-16-yl]oxy]-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol.
Chemical Property Profile of Balanitoside
Property Insights of Balanitoside
The XLogP value of -1.8 indicates that Balanitoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 366.0 Ų indicates high polarity, suggesting Balanitoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Balanitoside has 14 hydrogen bond donor(s) and 23 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Balanitoside?
The CAS number of Balanitoside is 94992-08-2.
What is the molecular formula of Balanitoside?
The molecular formula of Balanitoside is C51H84O23.
What is the molecular weight of Balanitoside?
The molecular weight of Balanitoside is 1064.54 g/mol.
Where can I buy Balanitoside?
You can request a quote for Balanitoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Balanitoside?
Yes, KEHONG BIO provides custom synthesis services for Balanitoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.