![(5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE structure](/static/products/4015/40158-95-0.webp)
(5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE
TL;DR: (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE (CAS 40158-95-0) is a chemical compound with molecular formula C18H23NO6 and molecular weight 349.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5R,12R,18R)-9-ethylidene-7-(hydroxymethyl)-5-methyl-3,6,11-trioxa-15-azatetracyclo[10.5.1.05,7.015,18]octadec-1(17)-ene-4,10-dione
Also Known As: (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE
| Molecular Formula | C18H23NO6 |
|---|---|
| Molecular Weight | 349.15 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 88.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 349.15253 |
| Heavy Atoms | 25 |
| Complexity | 685.0 |
Chemical Identifiers
| CAS Number | 40158-95-0 |
|---|---|
| SMILES | CC=C1CC2([C@@](O2)(C(=O)OCC3=CCN4[C@H]3[C@@H](CC4)OC1=O)C)CO |
| InChIKey | NOQVBHHOUTTZGE-XANYRSOKSA-N |
Product Overview
(5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE (CAS 40158-95-0), with molecular formula C18H23NO6 and molecular weight 349.15 g/mol. IUPAC: (5R,12R,18R)-9-ethylidene-7-(hydroxymethyl)-5-methyl-3,6,11-trioxa-15-azatetracyclo[10.5.1.05,7.015,18]octadec-1(17)-ene-4,10-dione.
Chemical Property Profile of (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE
Property Insights of (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE
The XLogP value of -0.2 indicates that (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 88.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE. Following Lipinski's Rule of Five, (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE?
The CAS number of (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE is 40158-95-0.
What is the molecular formula of (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE?
The molecular formula of (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE is C18H23NO6.
What is the molecular weight of (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE?
The molecular weight of (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE is 349.15 g/mol.
Where can I buy (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE?
You can request a quote for (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE?
Yes, KEHONG BIO provides custom synthesis services for (5R,9Z,12R,18R)-9-ETHYLIDENE-7-(HYDROXYMETHYL)-5-METHYL-3,6,11-TRIOXA-15-AZATETRACYCLO[10.5.1.0?,?.0(1)?,(1)?]OCTADEC-1(17)-ENE-4,10-DIONE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.