尿卟啉原III
TL;DR: 尿卟啉原III (CAS 1976-85-8) is a chemical compound with molecular formula C40H44N4O16 and molecular weight 836.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
尿卟啉原III
3-[7,12,18-tris(2-carboxyethyl)-3,8,13,17-tetrakis(carboxymethyl)-5,10,15,20,21,22,23,24-octahydroporphyrin-2-yl]propanoic acid
Also Known As: Uroporphyrinogen III, Uroporphyrinogens, Urogen III, uroporphyrinogen-III, uroporphyrinogen
| Molecular Formula | C40H44N4O16 |
|---|---|
| Molecular Weight | 836.28 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 362.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 20 |
| Exact Mass | 836.2752 |
| Heavy Atoms | 60 |
| Complexity | 1630.0 |
Chemical Identifiers
| CAS Number | 1976-85-8 |
|---|---|
| SMILES | C1C2=C(C(=C(N2)CC3=C(C(=C(N3)CC4=C(C(=C(N4)CC5=C(C(=C1N5)CCC(=O)O)CC(=O)O)CC(=O)O)CCC(=O)O)CC(=O)O)CCC(=O)O)CC(=O)O)CCC(=O)O |
| InChIKey | HUHWZXWWOFSFKF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
尿卟啉原III (CAS 1976-85-8), with molecular formula C40H44N4O16 and molecular weight 836.28 g/mol. IUPAC: 3-[7,12,18-tris(2-carboxyethyl)-3,8,13,17-tetrakis(carboxymethyl)-5,10,15,20,21,22,23,24-octahydroporphyrin-2-yl]propanoic acid.
Chemical Property Profile of 尿卟啉原III
Property Insights of 尿卟啉原III
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 尿卟啉原III. The TPSA of 362.0 Ų indicates high polarity, suggesting 尿卟啉原III may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 尿卟啉原III has 12 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 尿卟啉原III?
The CAS number of 尿卟啉原III is 1976-85-8.
What is the molecular formula of 尿卟啉原III?
The molecular formula of 尿卟啉原III is C40H44N4O16.
What is the molecular weight of 尿卟啉原III?
The molecular weight of 尿卟啉原III is 836.28 g/mol.
Where can I buy 尿卟啉原III?
You can request a quote for 尿卟啉原III directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 尿卟啉原III?
Yes, KEHONG BIO provides custom synthesis services for 尿卟啉原III and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.