Ono-DI-004
TL;DR: Ono-DI-004 (CAS 87-71-8) is a chemical compound with molecular formula C24H38O6 and molecular weight 422.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[(1R,2R,3R)-3-hydroxy-2-[(E,3S,5S)-3-hydroxy-5-methylnon-1-enyl]-5-oxocyclopentyl]acetyl]cyclohexane-1-carboxylic acid
Also Known As: ONO-DI-004, ONO-DI 004, J1.712.120K, 4-[2-[(1R,2R,3R)-3-hydroxy-2-[(E,3S,5S)-3-hydroxy-5-methylnon-1-enyl]-5-oxocyclopentyl]acetyl]cyclohexane-1-carboxylic acid, (1r,4r)-4-{2-[(1R,2R,3R)-3-hydroxy-2-[(1E,3S,5S)-3-hydroxy-5-methylnon-1-en-1-yl]-5-oxocyclopentyl]acetyl}cyclohexane-1-carboxylic acid
| Molecular Formula | C24H38O6 |
|---|---|
| Molecular Weight | 422.27 g/mol |
| LogP | 3.5362 |
| Topological Polar Surface Area | 111.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 422.26685 |
| Heavy Atoms | 30 |
| Complexity | 619.18567 |
Chemical Identifiers
| CAS Number | 87-71-8 |
|---|---|
| SMILES | CCCC[C@H](C)C[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1CC(=O)C2CCC(CC2)C(=O)O)O)O |
Product Overview
Ono-DI-004 (CAS 87-71-8), with molecular formula C24H38O6 and molecular weight 422.27 g/mol. IUPAC: 4-[2-[(1R,2R,3R)-3-hydroxy-2-[(E,3S,5S)-3-hydroxy-5-methylnon-1-enyl]-5-oxocyclopentyl]acetyl]cyclohexane-1-carboxylic acid.
Chemical Property Profile of Ono-DI-004
Property Insights of Ono-DI-004
The XLogP value of 3.5362 indicates that Ono-DI-004 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ono-DI-004. Following Lipinski's Rule of Five, Ono-DI-004 has 3 hydrogen bond donor(s) and 5 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 Ono-DI-004?
The CAS number of Ono-DI-004 is 87-71-8.
What is the molecular formula of Ono-DI-004?
The molecular formula of Ono-DI-004 is C24H38O6.
What is the molecular weight of Ono-DI-004?
The molecular weight of Ono-DI-004 is 422.27 g/mol.
Where can I buy Ono-DI-004?
You can request a quote for Ono-DI-004 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ono-DI-004?
Yes, KEHONG BIO provides custom synthesis services for Ono-DI-004 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.