Stellettin A
TL;DR: Stellettin A (CAS 160796-24-7) is a chemical compound with molecular formula C30H38O4 and molecular weight 462.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3a,6,6,9a-tetramethyl-3-[6-(5-methyl-6-oxopyran-2-yl)hepta-3,5-dien-2-ylidene]-4,5,5a,8,9,9b-hexahydro-1H-cyclopenta[a]naphthalene-2,7-dione
Also Known As: Stellettin A, Stellettin B, 3a,6,6,9a-tetramethyl-3-[6-(3-methyl-2-oxo-2h-pyran-6-yl)hepta-3,5-dien-2-ylidene]decahydro-1h-cyclopenta[a]naphthalene-2,7-dione, 3a,6,6,9a-tetramethyl-3-[6-(5-methyl-6-oxopyran-2-yl)hepta-3,5-dien-2-ylidene]-4,5,5a,8,9,9b-hexahydro-1H-cyclopenta[a]naphthalene-2,7-dione
| Molecular Formula | C30H38O4 |
|---|---|
| Molecular Weight | 462.28 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 462.277 |
| Heavy Atoms | 34 |
| Complexity | 1110.0 |
Chemical Identifiers
| CAS Number | 160796-24-7 |
|---|---|
| SMILES | CC1=CC=C(OC1=O)C(=CC=CC(=C2C(=O)CC3C2(CCC4C3(CCC(=O)C4(C)C)C)C)C)C |
| InChIKey | CXOJYPVZDPNKAI-UHFFFAOYSA-N |
Product Overview
Stellettin A (CAS 160796-24-7), with molecular formula C30H38O4 and molecular weight 462.28 g/mol. IUPAC: 3a,6,6,9a-tetramethyl-3-[6-(5-methyl-6-oxopyran-2-yl)hepta-3,5-dien-2-ylidene]-4,5,5a,8,9,9b-hexahydro-1H-cyclopenta[a]naphthalene-2,7-dione.
Chemical Property Profile of Stellettin A
Property Insights of Stellettin A
The XLogP value of 7.0 indicates that Stellettin A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Stellettin A. Following Lipinski's Rule of Five, Stellettin A has 0 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 Stellettin A?
The CAS number of Stellettin A is 160796-24-7.
What is the molecular formula of Stellettin A?
The molecular formula of Stellettin A is C30H38O4.
What is the molecular weight of Stellettin A?
The molecular weight of Stellettin A is 462.28 g/mol.
Where can I buy Stellettin A?
You can request a quote for Stellettin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Stellettin A?
Yes, KEHONG BIO provides custom synthesis services for Stellettin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.