Paciforgine
TL;DR: Paciforgine (CAS 136440-72-7) is a chemical compound with molecular formula C21H34O8 and molecular weight 414.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(13Z)-5,6,7,11-tetrahydroxy-3-[(E)-3-hydroxyprop-2-enyl]-4,7,9,13,14-pentamethyl-1-oxacyclotetradec-13-ene-2,10-dione
Also Known As: Paciforgine, Paciforgin, (13Z)-5,6,7,11-tetrahydroxy-3-[(E)-3-hydroxyprop-2-enyl]-4,7,9,13,14-pentamethyl-1-oxacyclotetradec-13-ene-2,10-dione, 5,6,7,11-tetrahydroxy-3-(3-hydroxyprop-2-en-1-yl)-4,7,9,13,14-pentamethyl-1-oxacyclotetradec-13-ene-2,10-dione, 5,6,7,11-Tetrahydroxy-4,7,9,13,14-pentamethyl-3-(3-hydroxy-2-propenyl)-1-oxacyclotetradeca-13-ene-2,10-dione
| Molecular Formula | C21H34O8 |
|---|---|
| Molecular Weight | 414.23 g/mol |
| LogP | 1.3703 |
| Topological Polar Surface Area | 144.52 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 414.22537 |
| Heavy Atoms | 29 |
| Complexity | 651.0665 |
Chemical Identifiers
| CAS Number | 136440-72-7 |
|---|---|
| SMILES | CC1CC(C(C(C(C(C(=O)O/C(=C(\CC(C1=O)O)/C)/C)C/C=C/O)C)O)O)(C)O |
Product Overview
Paciforgine (CAS 136440-72-7), with molecular formula C21H34O8 and molecular weight 414.23 g/mol. IUPAC: (13Z)-5,6,7,11-tetrahydroxy-3-[(E)-3-hydroxyprop-2-enyl]-4,7,9,13,14-pentamethyl-1-oxacyclotetradec-13-ene-2,10-dione.
Chemical Property Profile of Paciforgine
Property Insights of Paciforgine
The XLogP value of 1.3703 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Paciforgine. The TPSA of 144.52 Ų indicates high polarity, suggesting Paciforgine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Paciforgine has 5 hydrogen bond donor(s) and 8 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 Paciforgine?
The CAS number of Paciforgine is 136440-72-7.
What is the molecular formula of Paciforgine?
The molecular formula of Paciforgine is C21H34O8.
What is the molecular weight of Paciforgine?
The molecular weight of Paciforgine is 414.23 g/mol.
Where can I buy Paciforgine?
You can request a quote for Paciforgine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Paciforgine?
Yes, KEHONG BIO provides custom synthesis services for Paciforgine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.