2-Oxopomolic acid
TL;DR: 2-Oxopomolic acid (CAS 54963-52-9) is a chemical compound with molecular formula C30H46O5 and molecular weight 486.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,10-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-11-oxo-3,4,5,6,6a,7,8,8a,10,12,13,14b-dodecahydro-2H-picene-4a-carboxylic acid
Also Known As: 2-Oxopomolic acid
| Molecular Formula | C30H46O5 |
|---|---|
| Molecular Weight | 486.33 g/mol |
| LogP | 5.3834 |
| Topological Polar Surface Area | 94.83 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 486.33453 |
| Heavy Atoms | 35 |
| Complexity | 994.70593 |
Chemical Identifiers
| CAS Number | 54963-52-9 |
|---|---|
| SMILES | CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(=O)C(C5(C)C)O)C)C)C2C1(C)O)C)C(=O)O |
Product Overview
2-Oxopomolic acid (CAS 54963-52-9), with molecular formula C30H46O5 and molecular weight 486.33 g/mol. IUPAC: 1,10-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-11-oxo-3,4,5,6,6a,7,8,8a,10,12,13,14b-dodecahydro-2H-picene-4a-carboxylic acid.
Chemical Property Profile of 2-Oxopomolic acid
Property Insights of 2-Oxopomolic acid
The XLogP value of 5.3834 indicates that 2-Oxopomolic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Oxopomolic acid. Following Lipinski's Rule of Five, 2-Oxopomolic acid has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Oxopomolic acid?
The CAS number of 2-Oxopomolic acid is 54963-52-9.
What is the molecular formula of 2-Oxopomolic acid?
The molecular formula of 2-Oxopomolic acid is C30H46O5.
What is the molecular weight of 2-Oxopomolic acid?
The molecular weight of 2-Oxopomolic acid is 486.33 g/mol.
Where can I buy 2-Oxopomolic acid?
You can request a quote for 2-Oxopomolic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxopomolic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxopomolic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.