Medicagenic acid
TL;DR: Medicagenic acid (CAS 599-07-5) is a chemical compound with molecular formula C30H46O6 and molecular weight 502.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-2,3-dihydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4,8a-dicarboxylic acid
Also Known As: Medicagenic acid, Castanogenin, Medicogenic acid, medicagenicacid, Medicagensaure
| Molecular Formula | C30H46O6 |
|---|---|
| Molecular Weight | 502.33 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 502.32944 |
| Heavy Atoms | 36 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 599-07-5 |
|---|---|
| SMILES | C[C@@]12CC[C@@H]3[C@@]([C@H]1CC=C4[C@]2(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)(C[C@@H]([C@@H]([C@@]3(C)C(=O)O)O)O)C |
| InChIKey | IDGXIXSKISLYAC-WNTKNEGGSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Medicagenic acid (CAS 599-07-5), with molecular formula C30H46O6 and molecular weight 502.33 g/mol. IUPAC: (2S,3R,4S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-2,3-dihydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4,8a-dicarboxylic acid.
Chemical Property Profile of Medicagenic acid
Property Insights of Medicagenic acid
The XLogP value of 5.8 indicates that Medicagenic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Medicagenic acid. Following Lipinski's Rule of Five, Medicagenic acid has 4 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 Medicagenic acid?
The CAS number of Medicagenic acid is 599-07-5.
What is the molecular formula of Medicagenic acid?
The molecular formula of Medicagenic acid is C30H46O6.
What is the molecular weight of Medicagenic acid?
The molecular weight of Medicagenic acid is 502.33 g/mol.
Where can I buy Medicagenic acid?
You can request a quote for Medicagenic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Medicagenic acid?
Yes, KEHONG BIO provides custom synthesis services for Medicagenic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.