尿胆原
TL;DR: 尿胆原 (CAS 14684-37-8) is a chemical compound with molecular formula C33H44N4O6 and molecular weight 592.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
尿胆原
3-[2-[[3-(2-carboxyethyl)-5-[(3-ethyl-4-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-2-yl]methyl]-5-[(4-ethyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid
Also Known As: i-Urobilinogen, UROBILINOGEN, Mesobilirubinogen, urobilinogen IXalpha, mesobilirubinogen IXalpha
| Molecular Formula | C33H44N4O6 |
|---|---|
| Molecular Weight | 592.33 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 164.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 592.3261 |
| Heavy Atoms | 43 |
| Complexity | 1160.0 |
Chemical Identifiers
| CAS Number | 14684-37-8 |
|---|---|
| SMILES | CCC1=C(C(=O)NC1CC2=C(C(=C(N2)CC3=C(C(=C(N3)CC4C(=C(C(=O)N4)CC)C)C)CCC(=O)O)CCC(=O)O)C)C |
| InChIKey | OBHRVMZSZIDDEK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
尿胆原 (CAS 14684-37-8), with molecular formula C33H44N4O6 and molecular weight 592.33 g/mol. IUPAC: 3-[2-[[3-(2-carboxyethyl)-5-[(3-ethyl-4-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-2-yl]methyl]-5-[(4-ethyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid.
Chemical Property Profile of 尿胆原
Property Insights of 尿胆原
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 尿胆原. The TPSA of 164.0 Ų indicates high polarity, suggesting 尿胆原 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 尿胆原 has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 尿胆原?
The CAS number of 尿胆原 is 14684-37-8.
What is the molecular formula of 尿胆原?
The molecular formula of 尿胆原 is C33H44N4O6.
What is the molecular weight of 尿胆原?
The molecular weight of 尿胆原 is 592.33 g/mol.
Where can I buy 尿胆原?
You can request a quote for 尿胆原 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 尿胆原?
Yes, KEHONG BIO provides custom synthesis services for 尿胆原 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.