Succinylisocupressic acid
TL;DR: Succinylisocupressic acid (CAS 90374-86-0) is a chemical compound with molecular formula C24H36O6 and molecular weight 420.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,4aR,5S,8aR)-5-[(E)-5-(3-carboxypropanoyloxy)-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
Also Known As: Succinylisocupressic acid, Hexanedioic acid, di-C4-8-alkyl esters, Butanedioic acid, mono((2E)-5-((1S,4aR,5S,8aR)-5-carboxydecahydro-5,8a-dimethyl-2-methylene-1-naphthalenyl)-3-methyl-2-pentenyl) ester, (1S,4aR,5S,8aR)-5-[(3E)-5-[(3-carboxypropanoyl)oxy]-3-methylpent-3-en-1-yl]-1,4a-dimethyl-6-methylidene-decahydronaphthalene-1-carboxylic acid, (1S,4aR,5S,8aR)-5-[(E)-5-(4-hydroxy-4-oxobutanoyl)oxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
| Molecular Formula | C24H36O6 |
|---|---|
| Molecular Weight | 420.25 g/mol |
| LogP | 4.9844 |
| Topological Polar Surface Area | 100.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 420.2512 |
| Heavy Atoms | 30 |
| Complexity | 723.2078 |
Chemical Identifiers
| CAS Number | 90374-86-0 |
|---|---|
| SMILES | C/C(=C\COC(=O)CCC(=O)O)/CC[C@H]1C(=C)CC[C@@H]2[C@@]1(CCC[C@]2(C)C(=O)O)C |
Product Overview
Succinylisocupressic acid (CAS 90374-86-0), with molecular formula C24H36O6 and molecular weight 420.25 g/mol. IUPAC: (1S,4aR,5S,8aR)-5-[(E)-5-(3-carboxypropanoyloxy)-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid.
Chemical Property Profile of Succinylisocupressic acid
Property Insights of Succinylisocupressic acid
The XLogP value of 4.9844 indicates that Succinylisocupressic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Succinylisocupressic acid. Following Lipinski's Rule of Five, Succinylisocupressic acid has 2 hydrogen bond donor(s) and 4 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 Succinylisocupressic acid?
The CAS number of Succinylisocupressic acid is 90374-86-0.
What is the molecular formula of Succinylisocupressic acid?
The molecular formula of Succinylisocupressic acid is C24H36O6.
What is the molecular weight of Succinylisocupressic acid?
The molecular weight of Succinylisocupressic acid is 420.25 g/mol.
Where can I buy Succinylisocupressic acid?
You can request a quote for Succinylisocupressic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Succinylisocupressic acid?
Yes, KEHONG BIO provides custom synthesis services for Succinylisocupressic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.