Amicetin
TL;DR: Amicetin (CAS 17650-86-1) is a chemical compound with molecular formula C29H42N6O9 and molecular weight 618.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(2S)-2-amino-3-hydroxy-2-methylpropanoyl]amino]-N-[1-[(2R,5S,6R)-5-[(2R,3R,4S,5S,6R)-5-(dimethylamino)-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]-2-oxopyrimidin-4-yl]benzamide
Also Known As: AMICETIN, Sacromycin, Allomycin, Amicetin-A, Amicetin A
| Molecular Formula | C29H42N6O9 |
|---|---|
| Molecular Weight | 618.30 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 209.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 618.30133 |
| Heavy Atoms | 44 |
| Complexity | 1110.0 |
Chemical Identifiers
| CAS Number | 17650-86-1 |
|---|---|
| SMILES | C[C@@H]1[C@H](CC[C@@H](O1)N2C=CC(=NC2=O)NC(=O)C3=CC=C(C=C3)NC(=O)[C@](C)(CO)N)O[C@@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C)N(C)C)O)O |
| InChIKey | HDNVYHWHCVTDIV-ZENIWSRCSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Amicetin (CAS 17650-86-1), with molecular formula C29H42N6O9 and molecular weight 618.30 g/mol. IUPAC: 4-[[(2S)-2-amino-3-hydroxy-2-methylpropanoyl]amino]-N-[1-[(2R,5S,6R)-5-[(2R,3R,4S,5S,6R)-5-(dimethylamino)-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]-2-oxopyrimidin-4-yl]benzamide.
Chemical Property Profile of Amicetin
Property Insights of Amicetin
The XLogP value of -1.0 indicates that Amicetin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 209.0 Ų indicates high polarity, suggesting Amicetin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Amicetin has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Amicetin?
The CAS number of Amicetin is 17650-86-1.
What is the molecular formula of Amicetin?
The molecular formula of Amicetin is C29H42N6O9.
What is the molecular weight of Amicetin?
The molecular weight of Amicetin is 618.30 g/mol.
Where can I buy Amicetin?
You can request a quote for Amicetin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Amicetin?
Yes, KEHONG BIO provides custom synthesis services for Amicetin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.