3-Acetoxynorerythrosuamide
TL;DR: 3-Acetoxynorerythrosuamide (CAS 58189-26-7) is a chemical compound with molecular formula C26H39NO8 and molecular weight 493.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1R,2S,4aR,4bS,7E,8R,8aS,9R,10aR)-2-acetyloxy-9-hydroxy-1,4a,8-trimethyl-7-[2-[2-(methylamino)ethoxy]-2-oxoethylidene]-10-oxo-2,3,4,4b,5,6,8,8a,9,10a-decahydrophenanthrene-1-carboxylate
Also Known As: 3-Acetoxynorerythrosuamide, Methyl (13E)-3beta-(acetyloxy)-7beta-hydroxy-14alpha-methyl-13-{2-[2-(methylamino)ethoxy]-2-oxoethylidene}-6-oxopodocarpan-16-oate, methyl (1R,2S,4aR,4bS,7E,8R,8aS,9R,10aR)-2-acetyloxy-9-hydroxy-1,4a,8-trimethyl-7-[2-[2-(methylamino)ethoxy]-2-oxoethylidene]-10-oxo-2,3,4,4b,5,6,8,8a,9,10a-decahydrophenanthrene-1-carboxylate
| Molecular Formula | C26H39NO8 |
|---|---|
| Molecular Weight | 493.27 g/mol |
| LogP | 1.8086 |
| Topological Polar Surface Area | 128.23 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.26758 |
| Heavy Atoms | 35 |
| Complexity | 899.78265 |
Chemical Identifiers
| CAS Number | 58189-26-7 |
|---|---|
| SMILES | C[C@@H]\1[C@H]2[C@H](CC/C1=C\C(=O)OCCNC)[C@]3(CC[C@@H]([C@]([C@@H]3C(=O)[C@@H]2O)(C)C(=O)OC)OC(=O)C)C |
Product Overview
3-Acetoxynorerythrosuamide (CAS 58189-26-7), with molecular formula C26H39NO8 and molecular weight 493.27 g/mol. IUPAC: methyl (1R,2S,4aR,4bS,7E,8R,8aS,9R,10aR)-2-acetyloxy-9-hydroxy-1,4a,8-trimethyl-7-[2-[2-(methylamino)ethoxy]-2-oxoethylidene]-10-oxo-2,3,4,4b,5,6,8,8a,9,10a-decahydrophenanthrene-1-carboxylate.
Chemical Property Profile of 3-Acetoxynorerythrosuamide
Property Insights of 3-Acetoxynorerythrosuamide
The XLogP value of 1.8086 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Acetoxynorerythrosuamide. The TPSA of 128.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Acetoxynorerythrosuamide. Following Lipinski's Rule of Five, 3-Acetoxynorerythrosuamide has 2 hydrogen bond donor(s) and 9 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 3-Acetoxynorerythrosuamide?
The CAS number of 3-Acetoxynorerythrosuamide is 58189-26-7.
What is the molecular formula of 3-Acetoxynorerythrosuamide?
The molecular formula of 3-Acetoxynorerythrosuamide is C26H39NO8.
What is the molecular weight of 3-Acetoxynorerythrosuamide?
The molecular weight of 3-Acetoxynorerythrosuamide is 493.27 g/mol.
Where can I buy 3-Acetoxynorerythrosuamide?
You can request a quote for 3-Acetoxynorerythrosuamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Acetoxynorerythrosuamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Acetoxynorerythrosuamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.