EVONINE
TL;DR: EVONINE (CAS 33458-64-9) is a chemical compound with molecular formula C36H43NO17 and molecular weight 761.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,3R,13S,14S,17S,18R,19R,20S,21S,23R,24R)-18,19,21,24-tetraacetyloxy-25-hydroxy-3,13,14,25-tetramethyl-6,15,22-trioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7(12),8,10-trien-20-yl]methyl acetate
Also Known As: EVONINE, 8,11-Epoxy-9,12-ethano-11,15-methano-11H-(1,8)dioxacycloheptadecino(4,3-b)pyridine-5,17,22-trione, 10,13,14,21-tetrakis(acetyloxy)-12-((acetyloxy)methyl)-7,8,9,10,12,13,14,15,18,19-decahydro-20-hydroxy-8,18,19,20-tetramethyl-, (8R,9R,10R,11S,12S,13R,14R,15S,18S,19S,20S,21S)-, [(1S,3R,13S,14S,17S,18R,19R,20S,21S,23R,24R)-18,19,21,24-tetraacetyloxy-25-hydroxy-3,13,14,25-tetramethyl-6,15,22-trioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7(12),8,10-trien-20-yl]methyl acetate
| Molecular Formula | C36H43NO17 |
|---|---|
| Molecular Weight | 761.25 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 244.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 11 |
| Exact Mass | 761.2531 |
| Heavy Atoms | 54 |
| Complexity | 1610.0 |
Chemical Identifiers
| CAS Number | 33458-64-9 |
|---|---|
| SMILES | C[C@H]1[C@@H](C(=O)O[C@H]2[C@@H]([C@@H]([C@]3([C@@H](C(=O)[C@@H]4[C@H]([C@@]3(C2(C)O)O[C@]4(COC(=O)C5=C1N=CC=C5)C)OC(=O)C)OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C)C |
| InChIKey | IMIAGCONYJPMDY-DWKOBOQJSA-N |
Product Overview
EVONINE (CAS 33458-64-9), with molecular formula C36H43NO17 and molecular weight 761.25 g/mol. IUPAC: [(1S,3R,13S,14S,17S,18R,19R,20S,21S,23R,24R)-18,19,21,24-tetraacetyloxy-25-hydroxy-3,13,14,25-tetramethyl-6,15,22-trioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7(12),8,10-trien-20-yl]methyl acetate.
Chemical Property Profile of EVONINE
Property Insights of EVONINE
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EVONINE. The TPSA of 244.0 Ų indicates high polarity, suggesting EVONINE may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EVONINE has 1 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EVONINE?
The CAS number of EVONINE is 33458-64-9.
What is the molecular formula of EVONINE?
The molecular formula of EVONINE is C36H43NO17.
What is the molecular weight of EVONINE?
The molecular weight of EVONINE is 761.25 g/mol.
Where can I buy EVONINE?
You can request a quote for EVONINE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EVONINE?
Yes, KEHONG BIO provides custom synthesis services for EVONINE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.