Pseduotomatidin-5,20-dien diacetate
TL;DR: Pseduotomatidin-5,20-dien diacetate (CAS 5672-30-0) is a chemical compound with molecular formula C31H47NO4 and molecular weight 497.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-(4-acetamido-3-methylbutyl)-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-6,18-dien-16-yl] acetate
Also Known As: Pseduotomatidin-5,20-dien diacetate, [6-(4-Acetamido-3-methylbutyl)-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-6,18-dien-16-yl] acetate, 26-(Acetylamino)furosta-5,20(22)-dien-3-yl acetate #, N-[3-(Acetyloxy)furosta-5,20(22)-dien-27-yl]ethanimidic acid
| Molecular Formula | C31H47NO4 |
|---|---|
| Molecular Weight | 497.35 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 497.3505 |
| Heavy Atoms | 36 |
| Complexity | 968.0 |
Chemical Identifiers
| CAS Number | 5672-30-0 |
|---|---|
| SMILES | CC1=C(OC2C1C3(CCC4C(C3C2)CC=C5C4(CCC(C5)OC(=O)C)C)C)CCC(C)CNC(=O)C |
| InChIKey | FASZIBYTQUHVDL-UHFFFAOYSA-N |
Product Overview
Pseduotomatidin-5,20-dien diacetate (CAS 5672-30-0), with molecular formula C31H47NO4 and molecular weight 497.35 g/mol. IUPAC: [6-(4-acetamido-3-methylbutyl)-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-6,18-dien-16-yl] acetate.
Chemical Property Profile of Pseduotomatidin-5,20-dien diacetate
Property Insights of Pseduotomatidin-5,20-dien diacetate
The XLogP value of 5.5 indicates that Pseduotomatidin-5,20-dien diacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Pseduotomatidin-5,20-dien diacetate. Following Lipinski's Rule of Five, Pseduotomatidin-5,20-dien diacetate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pseduotomatidin-5,20-dien diacetate?
The CAS number of Pseduotomatidin-5,20-dien diacetate is 5672-30-0.
What is the molecular formula of Pseduotomatidin-5,20-dien diacetate?
The molecular formula of Pseduotomatidin-5,20-dien diacetate is C31H47NO4.
What is the molecular weight of Pseduotomatidin-5,20-dien diacetate?
The molecular weight of Pseduotomatidin-5,20-dien diacetate is 497.35 g/mol.
Where can I buy Pseduotomatidin-5,20-dien diacetate?
You can request a quote for Pseduotomatidin-5,20-dien diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseduotomatidin-5,20-dien diacetate?
Yes, KEHONG BIO provides custom synthesis services for Pseduotomatidin-5,20-dien diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.