Picfeltarraegenin IV
TL;DR: Picfeltarraegenin IV (CAS 82145-61-7) is a chemical compound with molecular formula C32H46O6 and molecular weight 526.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[16-hydroxy-4,4,9,13,14-pentamethyl-17-(2-methyl-3-oxo-5-propan-2-ylfuran-2-yl)-11-oxo-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] acetate
Also Known As: Picfeltarraegenin IV, NCI60_003658, [16-hydroxy-4,4,9,13,14-pentamethyl-17-(2-methyl-3-oxo-5-propan-2-ylfuran-2-yl)-11-oxo-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] acetate, 16-Hydroxy-9,10,14-trimethyl-11,22-dioxo-20,24-epoxy-4,9-cyclo-9,10-secocholesta-5,23-dien-1-yl acetate
| Molecular Formula | C32H46O6 |
|---|---|
| Molecular Weight | 526.33 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 526.32947 |
| Heavy Atoms | 38 |
| Complexity | 1150.0 |
Chemical Identifiers
| CAS Number | 82145-61-7 |
|---|---|
| SMILES | CC(C)C1=CC(=O)C(O1)(C)C2C(CC3(C2(CC(=O)C4(C3CC=C5C4CCC(C5(C)C)OC(=O)C)C)C)C)O |
| InChIKey | OAQPMBCYFIHMTG-UHFFFAOYSA-N |
Product Overview
Picfeltarraegenin IV (CAS 82145-61-7), with molecular formula C32H46O6 and molecular weight 526.33 g/mol. IUPAC: [16-hydroxy-4,4,9,13,14-pentamethyl-17-(2-methyl-3-oxo-5-propan-2-ylfuran-2-yl)-11-oxo-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] acetate.
Chemical Property Profile of Picfeltarraegenin IV
Property Insights of Picfeltarraegenin IV
The XLogP value of 4.7 indicates that Picfeltarraegenin IV is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Picfeltarraegenin IV. Following Lipinski's Rule of Five, Picfeltarraegenin IV has 1 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 Picfeltarraegenin IV?
The CAS number of Picfeltarraegenin IV is 82145-61-7.
What is the molecular formula of Picfeltarraegenin IV?
The molecular formula of Picfeltarraegenin IV is C32H46O6.
What is the molecular weight of Picfeltarraegenin IV?
The molecular weight of Picfeltarraegenin IV is 526.33 g/mol.
Where can I buy Picfeltarraegenin IV?
You can request a quote for Picfeltarraegenin IV directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Picfeltarraegenin IV?
Yes, KEHONG BIO provides custom synthesis services for Picfeltarraegenin IV and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.