马缨丹酸
TL;DR: 马缨丹酸 (CAS 60657-41-2) is a chemical compound with molecular formula C35H52O6 and molecular weight 568.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
马缨丹酸
20-hydroxy-8,8,14,15,19,19-hexamethyl-10-(3-methylbut-2-enoyloxy)-21-oxahexacyclo[18.2.2.01,18.02,15.05,14.06,11]tetracos-4-ene-11-carboxylic acid
Also Known As: lantanilic acid, Olean-12-en-28-oic acid, 3,25-epoxy-3-hydroxy-22-[(3-methyl-1-oxo-2-butenyl)oxy]-, hydroxy-hexamethyl-(3-methylbut-2-enoyloxy)[?]carboxylic acid, 3beta,25-Epoxy-3-hydroxy-22beta-[(3-methyl-1-oxo-2-butenyl)oxy]oleana-12-ene-28-oic acid, 20-hydroxy-8,8,14,15,19,19-hexamethyl-10-(3-methylbut-2-enoyloxy)-21-oxahexacyclo[18.2.2.01,18.02,15.05,14.06,11]tetracos-4-ene-11-carboxylic acid
| Molecular Formula | C35H52O6 |
|---|---|
| Molecular Weight | 568.38 g/mol |
| LogP | 7.4 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 568.3764 |
| Heavy Atoms | 41 |
| Complexity | 1220.0 |
Chemical Identifiers
| CAS Number | 60657-41-2 |
|---|---|
| SMILES | CC(=CC(=O)OC1CC(CC2C1(CCC3(C2=CCC4C3(CCC5C46CCC(C5(C)C)(OC6)O)C)C)C(=O)O)(C)C)C |
| InChIKey | HGMVESCHSMFWDD-UHFFFAOYSA-N |
Product Overview
马缨丹酸 (CAS 60657-41-2), with molecular formula C35H52O6 and molecular weight 568.38 g/mol. IUPAC: 20-hydroxy-8,8,14,15,19,19-hexamethyl-10-(3-methylbut-2-enoyloxy)-21-oxahexacyclo[18.2.2.01,18.02,15.05,14.06,11]tetracos-4-ene-11-carboxylic acid.
Chemical Property Profile of 马缨丹酸
Property Insights of 马缨丹酸
The XLogP value of 7.4 indicates that 马缨丹酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 马缨丹酸. Following Lipinski's Rule of Five, 马缨丹酸 has 2 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 马缨丹酸?
The CAS number of 马缨丹酸 is 60657-41-2.
What is the molecular formula of 马缨丹酸?
The molecular formula of 马缨丹酸 is C35H52O6.
What is the molecular weight of 马缨丹酸?
The molecular weight of 马缨丹酸 is 568.38 g/mol.
Where can I buy 马缨丹酸?
You can request a quote for 马缨丹酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 马缨丹酸?
Yes, KEHONG BIO provides custom synthesis services for 马缨丹酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.