Stichloroside B1
TL;DR: Stichloroside B1 (CAS 78244-74-3) is a chemical compound with molecular formula C68H110O33 and molecular weight 1454.69 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[16-[5-[4-[3,5-dihydroxy-6-(hydroxymethyl)-4-methoxyoxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[5-[4-[3,5-dihydroxy-6-(hydroxymethyl)-4-methoxyoxan-2-yl]oxy-3,5-dihydroxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxyoxan-2-yl]oxy-2,6,13,17,17-pentamethyl-8-oxo-7-oxapentacyclo[10.8.0.02,9.05,9.013,18]icos-1(20)-en-6-yl]-4-methylpentan-2-yl] acetate
Also Known As: STICHLOROSIDE B1, [1-[16-[5-[4-[3,5-Dihydroxy-6-(hydroxymethyl)-4-methoxyoxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[5-[4-[3,5-dihydroxy-6-(hydroxymethyl)-4-methoxyoxan-2-yl]oxy-3,5-dihydroxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxyoxan-2-yl]oxy-2,6,13,17,17-pentamethyl-8-oxo-7-oxapentacyclo[10.8.0.02,9.05,9.013,18]icos-1(20)-en-6-yl]-4-methylpentan-2-yl] acetate, Lanost-7-en-18-oic acid, 23-(acetyloxy)-20-hydroxy-3-((O-3-O-methyl-beta-D-glucopyranosyl-(1->3)-O-beta-D-glucopyranosyl-(1->4)-O-(O-3-O-methyl-beta-D-glucopyranosyl-(1->3)-O-beta-D-xylopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->2))-beta-D-xylopyranosyl)oxy)-, gamma-lactone, (3beta,9beta,23S)-
| Molecular Formula | C68H110O33 |
|---|---|
| Molecular Weight | 1454.69 g/mol |
| LogP | -2.3 |
| Topological Polar Surface Area | 485.0 Ų |
| Hydrogen Bond Donors | 15 |
| Hydrogen Bond Acceptors | 33 |
| Rotatable Bonds | 24 |
| Exact Mass | 1454.693 |
| Heavy Atoms | 101 |
| Complexity | 2820.0 |
Chemical Identifiers
| CAS Number | 78244-74-3 |
|---|---|
| SMILES | CC(C)CC(CC1(C2CCC3(C2(CCC4C3=CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)OC7C(C(C(C(O7)CO)O)OC8C(C(C(C(O8)CO)O)OC)O)O)O)OC9C(C(C(C(O9)CO)OC2C(C(C(CO2)O)OC2C(C(C(C(O2)CO)O)OC)O)O)O)O)C)C(=O)O1)C)C)OC(=O)C |
| InChIKey | UNPQYALZMSWCEF-UHFFFAOYSA-N |
Product Overview
Stichloroside B1 (CAS 78244-74-3), with molecular formula C68H110O33 and molecular weight 1454.69 g/mol. IUPAC: [1-[16-[5-[4-[3,5-dihydroxy-6-(hydroxymethyl)-4-methoxyoxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[5-[4-[3,5-dihydroxy-6-(hydroxymethyl)-4-methoxyoxan-2-yl]oxy-3,5-dihydroxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxyoxan-2-yl]oxy-2,6,13,17,17-pentamethyl-8-oxo-7-oxapentacyclo[10.8.0.02,9.05,9.013,18]icos-1(20)-en-6-yl]-4-methylpentan-2-yl] acetate.
Chemical Property Profile of Stichloroside B1
Property Insights of Stichloroside B1
The XLogP value of -2.3 indicates that Stichloroside B1 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 485.0 Ų indicates high polarity, suggesting Stichloroside B1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Stichloroside B1 has 15 hydrogen bond donor(s) and 33 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Stichloroside B1?
The CAS number of Stichloroside B1 is 78244-74-3.
What is the molecular formula of Stichloroside B1?
The molecular formula of Stichloroside B1 is C68H110O33.
What is the molecular weight of Stichloroside B1?
The molecular weight of Stichloroside B1 is 1454.69 g/mol.
Where can I buy Stichloroside B1?
You can request a quote for Stichloroside B1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Stichloroside B1?
Yes, KEHONG BIO provides custom synthesis services for Stichloroside B1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.