methyl trisporate E
TL;DR: methyl trisporate E (CAS 90902-25-3) is a chemical compound with molecular formula C19H28O5 and molecular weight 336.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-hydroxy-2-[(1E,3E)-7-hydroxy-3-methylocta-1,3-dienyl]-1,3-dimethyl-4-oxocyclohex-2-ene-1-carboxylate
Also Known As: Methyl trisporate E, Trisporic acid methyl ester, methyl 6-hydroxy-2-[(1E,3E)-7-hydroxy-3-methylocta-1,3-dienyl]-1,3-dimethyl-4-oxocyclohex-2-ene-1-carboxylate, 1,5-Dimethyl-2-hydroxy-4-oxo-6-(2'-hydroxy-6'-methylocta-5',7'-dien-8'-yl)-5-cyclohexene-1-carboxylic acid methyl ester, 2-Cyclohexene-1-carboxylic acid, 6-hydroxy-2-(7-hydroxy-3-methyl-1,3-octadienyl)-1,3-dimethyl-4-oxo-, (1R-(1alpha,2(1E,3E,7R*),6alpha))-
| Molecular Formula | C19H28O5 |
|---|---|
| Molecular Weight | 336.19 g/mol |
| LogP | 2.4794 |
| Topological Polar Surface Area | 83.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.19366 |
| Heavy Atoms | 24 |
| Complexity | 582.5646 |
Chemical Identifiers
| CAS Number | 90902-25-3 |
|---|---|
| SMILES | CC1=C(C(C(CC1=O)O)(C)C(=O)OC)/C=C/C(=C/CCC(C)O)/C |
Product Overview
methyl trisporate E (CAS 90902-25-3), with molecular formula C19H28O5 and molecular weight 336.19 g/mol. IUPAC: methyl 6-hydroxy-2-[(1E,3E)-7-hydroxy-3-methylocta-1,3-dienyl]-1,3-dimethyl-4-oxocyclohex-2-ene-1-carboxylate.
Chemical Property Profile of methyl trisporate E
Property Insights of methyl trisporate E
The XLogP value of 2.4794 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl trisporate E. The TPSA of 83.83 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl trisporate E. Following Lipinski's Rule of Five, methyl trisporate E has 2 hydrogen bond donor(s) and 5 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 methyl trisporate E?
The CAS number of methyl trisporate E is 90902-25-3.
What is the molecular formula of methyl trisporate E?
The molecular formula of methyl trisporate E is C19H28O5.
What is the molecular weight of methyl trisporate E?
The molecular weight of methyl trisporate E is 336.19 g/mol.
Where can I buy methyl trisporate E?
You can request a quote for methyl trisporate E directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl trisporate E?
Yes, KEHONG BIO provides custom synthesis services for methyl trisporate E and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.