Penitrem F
TL;DR: Penitrem F (CAS 78213-65-7) is a chemical compound with molecular formula C37H44ClNO5 and molecular weight 617.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R,5S,6S,8R,9S,10R,12S,15R,16S,25S,27S,28S)-21-chloro-15,16,33,33-tetramethyl-24-methylidene-10-prop-1-en-2-yl-7,11,32-trioxa-18-azadecacyclo[25.4.2.02,16.05,15.06,8.06,12.017,31.019,30.022,29.025,28]tritriaconta-17(31),19,21,29-tetraene-5,9-diol
Also Known As: PENITREM F, 15-Deoxypenitrem A, Penitrem A, 15-deoxy-, 7,8-(Epoxymethano)-2H,6H-cyclobuta(5,6)benz(1,2-e)oxireno(4',4'a)-1-benzopyrano(5',6':6,7)indeno(1,2-b)indole-3,4b(5H)-diol,12-chloro-3,3a,6a,7,7d,8,9,9a,10,11,14,14b,14c,15,16,16a-hexadecahydro-14b,14c,17,17-tetramethyl-10-methylene-2-(1-methylethenyl)-, (2R,3S,3aR,4aS,4bS,6aR,7S,7dS,8S,9aS,14bS,14cR,16aS)-, (1S,2R,5S,6S,8R,9S,10R,12S,15R,16S,25S,27S,28S)-21-chloro-15,16,33,33-tetramethyl-24-methylidene-10-prop-1-en-2-yl-7,11,32-trioxa-18-azadecacyclo[25.4.2.02,16.05,15.06,8.06,12.017,31.019,30.022,29.025,28]tritriaconta-17(31),19,21,29-tetraene-5,9-diol
| Molecular Formula | C37H44ClNO5 |
|---|---|
| Molecular Weight | 617.29 g/mol |
| LogP | 6.5577 |
| Topological Polar Surface Area | 87.24 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 617.2908 |
| Heavy Atoms | 44 |
| Complexity | 1744.4418 |
Chemical Identifiers
| CAS Number | 78213-65-7 |
|---|---|
| SMILES | CC(=C)[C@@H]1[C@@H]([C@@H]2[C@@]3(O2)[C@@H](O1)CC[C@]4([C@]3(CC[C@@H]5[C@@]4(C6=C7[C@H]5OC([C@H]8C[C@H]9[C@@H]8C1=C7C(=CC(=C1CC9=C)Cl)N6)(C)C)C)O)C)O |
Product Overview
Penitrem F (CAS 78213-65-7), with molecular formula C37H44ClNO5 and molecular weight 617.29 g/mol. IUPAC: (1S,2R,5S,6S,8R,9S,10R,12S,15R,16S,25S,27S,28S)-21-chloro-15,16,33,33-tetramethyl-24-methylidene-10-prop-1-en-2-yl-7,11,32-trioxa-18-azadecacyclo[25.4.2.02,16.05,15.06,8.06,12.017,31.019,30.022,29.025,28]tritriaconta-17(31),19,21,29-tetraene-5,9-diol.
Chemical Property Profile of Penitrem F
Property Insights of Penitrem F
The XLogP value of 6.5577 indicates that Penitrem F is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.24 Ų falls within the moderate polarity range, balancing permeability and solubility for Penitrem F. Following Lipinski's Rule of Five, Penitrem F has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Penitrem F?
The CAS number of Penitrem F is 78213-65-7.
What is the molecular formula of Penitrem F?
The molecular formula of Penitrem F is C37H44ClNO5.
What is the molecular weight of Penitrem F?
The molecular weight of Penitrem F is 617.29 g/mol.
Where can I buy Penitrem F?
You can request a quote for Penitrem F directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Penitrem F?
Yes, KEHONG BIO provides custom synthesis services for Penitrem F and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.