Paspalitrem A
TL;DR: Paspalitrem A (CAS 63722-90-7) is a chemical compound with molecular formula C32H39NO4 and molecular weight 501.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
19-hydroxy-4,5,24,24-tetramethyl-11-(3-methylbut-2-enyl)-25,26-dioxa-7-azaheptacyclo[21.2.1.01,20.04,19.05,16.06,14.08,13]hexacosa-6(14),8(13),9,11,20-pentaen-22-one
Also Known As: Paspalitrem A, 5b-Hydroxy-2,2,13b,13c-tetramethyl-10-(3-methylbut-2-en-1-yl)-2,3,5b,6,7,7a,8,13,13b,13c,14,15-dodecahydro-4H-3,15a-epoxy[1]benzoxepino[6',7':6,7]indeno[1,2-b]indol-4-one
| Molecular Formula | C32H39NO4 |
|---|---|
| Molecular Weight | 501.29 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 71.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 501.2879 |
| Heavy Atoms | 37 |
| Complexity | 1090.0 |
Chemical Identifiers
| CAS Number | 63722-90-7 |
|---|---|
| SMILES | CC(=CCC1=CC2=C(C=C1)NC3=C2CC4C3(C5(CCC67C(=CC(=O)C(O6)C(O7)(C)C)C5(CC4)O)C)C)C |
| InChIKey | WCISYVSWAOUFIY-UHFFFAOYSA-N |
Product Overview
Paspalitrem A (CAS 63722-90-7), with molecular formula C32H39NO4 and molecular weight 501.29 g/mol. IUPAC: 19-hydroxy-4,5,24,24-tetramethyl-11-(3-methylbut-2-enyl)-25,26-dioxa-7-azaheptacyclo[21.2.1.01,20.04,19.05,16.06,14.08,13]hexacosa-6(14),8(13),9,11,20-pentaen-22-one.
Chemical Property Profile of Paspalitrem A
Property Insights of Paspalitrem A
The XLogP value of 5.1 indicates that Paspalitrem A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Paspalitrem A. Following Lipinski's Rule of Five, Paspalitrem A has 2 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 Paspalitrem A?
The CAS number of Paspalitrem A is 63722-90-7.
What is the molecular formula of Paspalitrem A?
The molecular formula of Paspalitrem A is C32H39NO4.
What is the molecular weight of Paspalitrem A?
The molecular weight of Paspalitrem A is 501.29 g/mol.
Where can I buy Paspalitrem A?
You can request a quote for Paspalitrem A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Paspalitrem A?
Yes, KEHONG BIO provides custom synthesis services for Paspalitrem A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.