Gypsetin
TL;DR: Gypsetin (CAS 19152-48-8) is a chemical compound with molecular formula C32H36N4O4 and molecular weight 540.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,4R,12S,14S,17S,25R)-12,25-dihydroxy-4,17-bis(2-methylbut-3-en-2-yl)-3,5,16,18-tetrazaheptacyclo[14.10.0.03,14.04,12.06,11.017,25.019,24]hexacosa-6,8,10,19,21,23-hexaene-2,15-dione
Also Known As: Gypsetin, Gypsetine, gipsetin, (-)-Gypsetin, KST-1A2367
| Molecular Formula | C32H36N4O4 |
|---|---|
| Molecular Weight | 540.27 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 540.2737 |
| Heavy Atoms | 40 |
| Complexity | 1100.0 |
Chemical Identifiers
| CAS Number | 19152-48-8 |
|---|---|
| SMILES | CC(C)(C=C)[C@@]12[C@@](C[C@@H]3N1C(=O)[C@@H]4C[C@@]5(C6=CC=CC=C6N[C@@]5(N4C3=O)C(C)(C)C=C)O)(C7=CC=CC=C7N2)O |
| InChIKey | CXDDBHFLLPBKRS-OVYULKEKSA-N |
Product Overview
Gypsetin (CAS 19152-48-8), with molecular formula C32H36N4O4 and molecular weight 540.27 g/mol. IUPAC: (1S,4R,12S,14S,17S,25R)-12,25-dihydroxy-4,17-bis(2-methylbut-3-en-2-yl)-3,5,16,18-tetrazaheptacyclo[14.10.0.03,14.04,12.06,11.017,25.019,24]hexacosa-6,8,10,19,21,23-hexaene-2,15-dione.
Chemical Property Profile of Gypsetin
Property Insights of Gypsetin
The XLogP value of 4.2 indicates that Gypsetin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Gypsetin. Following Lipinski's Rule of Five, Gypsetin has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Gypsetin?
The CAS number of Gypsetin is 19152-48-8.
What is the molecular formula of Gypsetin?
The molecular formula of Gypsetin is C32H36N4O4.
What is the molecular weight of Gypsetin?
The molecular weight of Gypsetin is 540.27 g/mol.
Where can I buy Gypsetin?
You can request a quote for Gypsetin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Gypsetin?
Yes, KEHONG BIO provides custom synthesis services for Gypsetin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.