Chorchoionoside B
TL;DR: Chorchoionoside B (CAS 189344-54-5) is a chemical compound with molecular formula C19H28O9 and molecular weight 400.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S)-4-hydroxy-3,5,5-trimethyl-4-[(E)-3-oxo-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-1-enyl]cyclohex-2-en-1-one
Also Known As: Chorchoionoside B, Corchoionoside B, (4S)-4-((1E)-4-(beta-D-Glucopyranosyloxy)-3-oxo-1-buten-1-yl)-4-hydroxy-3,5,5-trimethyl-2-cyclohexen-1-one, (3E)-4-[(1S)-1-Hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-2-oxobut-3-en-1-yl beta-D-glucopyranoside, (4S)-4-[(1E)-4-(I(2)-D-Glucopyranosyloxy)-3-oxo-1-buten-1-yl]-4-hydroxy-3,5,5-trimethyl-2-cyclohexen-1-one
| Molecular Formula | C19H28O9 |
|---|---|
| Molecular Weight | 400.17 g/mol |
| LogP | -1.3954 |
| Topological Polar Surface Area | 153.75 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.17334 |
| Heavy Atoms | 28 |
| Complexity | 666.3154 |
Chemical Identifiers
| CAS Number | 189344-54-5 |
|---|---|
| SMILES | CC1=CC(=O)CC([C@]1(/C=C/C(=O)CO[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)(C)C |
Product Overview
Chorchoionoside B (CAS 189344-54-5), with molecular formula C19H28O9 and molecular weight 400.17 g/mol. IUPAC: (4S)-4-hydroxy-3,5,5-trimethyl-4-[(E)-3-oxo-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-1-enyl]cyclohex-2-en-1-one.
Chemical Property Profile of Chorchoionoside B
Property Insights of Chorchoionoside B
The XLogP value of -1.3954 indicates that Chorchoionoside B is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 153.75 Ų indicates high polarity, suggesting Chorchoionoside B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Chorchoionoside B 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 Chorchoionoside B?
The CAS number of Chorchoionoside B is 189344-54-5.
What is the molecular formula of Chorchoionoside B?
The molecular formula of Chorchoionoside B is C19H28O9.
What is the molecular weight of Chorchoionoside B?
The molecular weight of Chorchoionoside B is 400.17 g/mol.
Where can I buy Chorchoionoside B?
You can request a quote for Chorchoionoside B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chorchoionoside B?
Yes, KEHONG BIO provides custom synthesis services for Chorchoionoside B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.