Cyclovirobuxeine A
TL;DR: Cyclovirobuxeine A (CAS 7727-91-5) is a chemical compound with molecular formula C28H48N2O and molecular weight 428.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(dimethylamino)-15-[1-(dimethylamino)ethyl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadec-9-en-14-ol
Also Known As: Cyclovirobuxeine A, dimethylamino-[1-(dimethylamino)ethyl]-tetramethyl-[?]ol, 7-(Dimethylamino)-1-(1-(dimethylamino)ethyl)-3a,6,6,12a-tetramethyl-2,3,3a,3b,5a,6,7,8,9,11,12,12a-dodecahydro-1H-cyclopenta(a)cyclopropa(e)phenanthren-2-ol, 9,19-Cyclopregn-6-en-16-ol, 3,20-bis(dimethylamino)-4,4,14-trimethyl-[3.beta.,5.alpha.,16.alpha.,20S]-, 9,19-CYCLOPREGN-6-EN-16-OL, 3,20-BIS(DIMETHYLAMINO)-4,4,14-TRIMETHYL-[3SS,5A,16A,20S]-
| Molecular Formula | C28H48N2O |
|---|---|
| Molecular Weight | 428.38 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 26.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 428.37668 |
| Heavy Atoms | 31 |
| Complexity | 788.0 |
Chemical Identifiers
| CAS Number | 7727-91-5 |
|---|---|
| SMILES | CC(C1C(CC2(C1(CCC34C2C=CC5C3(C4)CCC(C5(C)C)N(C)C)C)C)O)N(C)C |
| InChIKey | UVWOWJBPZRXVCO-UHFFFAOYSA-N |
Product Overview
Cyclovirobuxeine A (CAS 7727-91-5), with molecular formula C28H48N2O and molecular weight 428.38 g/mol. IUPAC: 6-(dimethylamino)-15-[1-(dimethylamino)ethyl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadec-9-en-14-ol.
Chemical Property Profile of Cyclovirobuxeine A
Property Insights of Cyclovirobuxeine A
The XLogP value of 5.7 indicates that Cyclovirobuxeine A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.7 Ų, Cyclovirobuxeine A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclovirobuxeine A has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cyclovirobuxeine A?
The CAS number of Cyclovirobuxeine A is 7727-91-5.
What is the molecular formula of Cyclovirobuxeine A?
The molecular formula of Cyclovirobuxeine A is C28H48N2O.
What is the molecular weight of Cyclovirobuxeine A?
The molecular weight of Cyclovirobuxeine A is 428.38 g/mol.
Where can I buy Cyclovirobuxeine A?
You can request a quote for Cyclovirobuxeine A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclovirobuxeine A?
Yes, KEHONG BIO provides custom synthesis services for Cyclovirobuxeine A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.