Estriol Succinate
TL;DR: Estriol Succinate (CAS 514-68-1) is a chemical compound with molecular formula C26H32O9 and molecular weight 488.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(8R,9S,13S,14S,16R,17R)-17-(3-carboxypropanoyloxy)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-16-yl]oxy]-4-oxobutanoic acid
Also Known As: ESTRIOL SUCCINATE, Estriolo succinato, succinylestriol, Estrioli succinas, Oestriol succinate
| Molecular Formula | C26H32O9 |
|---|---|
| Molecular Weight | 488.20 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 488.20462 |
| Heavy Atoms | 35 |
| Complexity | 841.0 |
Chemical Identifiers
| CAS Number | 514-68-1 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@H]([C@@H]2OC(=O)CCC(=O)O)OC(=O)CCC(=O)O)CCC4=C3C=CC(=C4)O |
| InChIKey | VBRVDDFOBZNCPF-BRSFZVHSSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Estriol Succinate (CAS 514-68-1), with molecular formula C26H32O9 and molecular weight 488.20 g/mol. IUPAC: 4-[[(8R,9S,13S,14S,16R,17R)-17-(3-carboxypropanoyloxy)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-16-yl]oxy]-4-oxobutanoic acid.
Chemical Property Profile of Estriol Succinate
Property Insights of Estriol Succinate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Estriol Succinate. The TPSA of 147.0 Ų indicates high polarity, suggesting Estriol Succinate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Estriol Succinate has 3 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 Estriol Succinate?
The CAS number of Estriol Succinate is 514-68-1.
What is the molecular formula of Estriol Succinate?
The molecular formula of Estriol Succinate is C26H32O9.
What is the molecular weight of Estriol Succinate?
The molecular weight of Estriol Succinate is 488.20 g/mol.
Where can I buy Estriol Succinate?
You can request a quote for Estriol Succinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Estriol Succinate?
Yes, KEHONG BIO provides custom synthesis services for Estriol Succinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.