Staphidine
TL;DR: Staphidine (CAS 59588-15-7) is a chemical compound with molecular formula C42H58N2O and molecular weight 606.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5',7,7'-tetramethylspiro[20-oxa-7-azaheptacyclo[13.6.1.15,9.01,12.04,11.014,16.016,21]tricosa-4(11),12-diene-19,12'-7-azahexacyclo[9.6.2.01,8.05,17.09,14.014,18]nonadecane]
Also Known As: Demethoxystaphisine, Staphimine, 19,21-dihydro-21-methyl-, Staphimine,21-dihydro-21-methyl-, tetramethyl-[?],[?]-spirobi[[?]], J2.406.623A
| Molecular Formula | C42H58N2O |
|---|---|
| Molecular Weight | 606.45 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 15.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 606.4549 |
| Heavy Atoms | 45 |
| Complexity | 1550.0 |
Chemical Identifiers
| CAS Number | 59588-15-7 |
|---|---|
| SMILES | CC12CCCC34C1CCC56C3CC(CC5C4N(C2)C)C7(C6)CCC89C1C8C=C2C3=C(CCC2(C1)C9O7)C1(CC(C3)CN(C1)C)C |
| InChIKey | MIQIFBIWUBAPTB-UHFFFAOYSA-N |
Product Overview
Staphidine (CAS 59588-15-7), with molecular formula C42H58N2O and molecular weight 606.45 g/mol. IUPAC: 5,5',7,7'-tetramethylspiro[20-oxa-7-azaheptacyclo[13.6.1.15,9.01,12.04,11.014,16.016,21]tricosa-4(11),12-diene-19,12'-7-azahexacyclo[9.6.2.01,8.05,17.09,14.014,18]nonadecane].
Chemical Property Profile of Staphidine
Property Insights of Staphidine
The XLogP value of 6.5 indicates that Staphidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.7 Ų, Staphidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Staphidine has 0 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 Staphidine?
The CAS number of Staphidine is 59588-15-7.
What is the molecular formula of Staphidine?
The molecular formula of Staphidine is C42H58N2O.
What is the molecular weight of Staphidine?
The molecular weight of Staphidine is 606.45 g/mol.
Where can I buy Staphidine?
You can request a quote for Staphidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Staphidine?
Yes, KEHONG BIO provides custom synthesis services for Staphidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.