6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))-
TL;DR: 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))- (CAS 16609-79-3) is a chemical compound with molecular formula C29H39NO5 and molecular weight 481.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,6R,14R,15S,19R)-19-[(2R)-2-hydroxy-5-methylhexan-2-yl]-15-methoxy-5-methyl-13-oxa-5-azahexacyclo[13.2.2.12,8.01,6.02,14.012,20]icosa-8(20),9,11,16-tetraen-11-yl] acetate
Also Known As: 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))-, (4R,7S,7aR,12bS,14R)-14-[(2R)-2-Hydroxy-5-methylhexan-2-yl]-7-methoxy-3-methyl-1,2,3,4,7,7a-hexahydro-4a,7-ethano-4,12-methano[1]benzofuro[3,2-e]isoquinolin-9-yl acetate, 14-(2-Hydroxy-5-methylhexan-2-yl)-7-methoxy-3-methyl-1,2,3,4,7,7a-hexahydro-4a,7-ethano-4,12-methano[1]benzofuro[3,2-e]isoquinolin-9-yl acetate, BRN 4947789, RefChem:305972
| Molecular Formula | C29H39NO5 |
|---|---|
| Molecular Weight | 481.28 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 481.28284 |
| Heavy Atoms | 35 |
| Complexity | 921.0 |
Chemical Identifiers
| CAS Number | 16609-79-3 |
|---|---|
| SMILES | CC(C)CC[C@](C)([C@H]1CC23C=C[C@]1([C@H]4[C@@]25CCN([C@@H]3CC6=C5C(=C(C=C6)OC(=O)C)O4)C)OC)O |
| InChIKey | RTNBUYPWHDMINM-WTDSKIOASA-N |
Product Overview
6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))- (CAS 16609-79-3), with molecular formula C29H39NO5 and molecular weight 481.28 g/mol. IUPAC: [(2S,6R,14R,15S,19R)-19-[(2R)-2-hydroxy-5-methylhexan-2-yl]-15-methoxy-5-methyl-13-oxa-5-azahexacyclo[13.2.2.12,8.01,6.02,14.012,20]icosa-8(20),9,11,16-tetraen-11-yl] acetate.
Chemical Property Profile of 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))-
Property Insights of 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))-
The XLogP value of 4.0 indicates that 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))-. Following Lipinski's Rule of Five, 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))- has 1 hydrogen bond donor(s) and 6 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 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))-?
The CAS number of 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))- is 16609-79-3.
What is the molecular formula of 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))-?
The molecular formula of 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))- is C29H39NO5.
What is the molecular weight of 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))-?
The molecular weight of 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))- is 481.28 g/mol.
Where can I buy 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))-?
You can request a quote for 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))-?
Yes, KEHONG BIO provides custom synthesis services for 6,14-Ethenomorphinan-7-methanol, 3-(acetyloxy)-alpha,17-dimethyl-4,5-epoxy-6-methoxy-alpha-(3-methylbutyl)-, (5-alpha,7-alpha(R))- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.