Ustiloxin C
TL;DR: Ustiloxin C (CAS 158274-98-7) is a chemical compound with molecular formula C23H34N4O10S and molecular weight 558.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-ethyl-11,15-dihydroxy-13-(2-hydroxyethylsulfinyl)-3,7-dimethyl-10-(methylamino)-6,9-dioxo-2-oxa-5,8-diazabicyclo[10.3.1]hexadeca-1(15),12(16),13-triene-4-carbonyl]amino]acetic acid
Also Known As: Ustiloxin C, 2-[[3-ethyl-11,15-dihydroxy-13-(2-hydroxyethylsulfinyl)-3,7-dimethyl-10-(methylamino)-6,9-dioxo-2-oxa-5,8-diazabicyclo[10.3.1]hexadeca-1(15),12(16),13-triene-4-carbonyl]amino]acetic acid, (beta-R)-beta,5-Dihydroxy-2-((R)-(2-hydroxyethyl)sulfinyl)-N-methyl-L-tyrosyl-L-valyl-3-hydroxy-L-isoleucylglycine cyclic (1(sup 5)-3)-ether, 2-[[10-ethyl-2,13-dihydroxy-15-(2-hydroxyethylsulfinyl)-6,10-dimethyl-3-(methylamino)-4,7-dioxo-11-oxa-5,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-triene-9-carbonyl]amino]acetic acid, 2-[[3-ethyl-11,15-dihydroxy-13-(2-hydroxyethylsulinyl)-3,7-dimethyl-10-(methylamino)-6,9-dioxo-2-oxa-5,8-diazabicyclo[10.3.1]hexadeca-1(15),12(16),13-triene-4-carbonyl]amino]acetic acid
| Molecular Formula | C23H34N4O10S |
|---|---|
| Molecular Weight | 558.20 g/mol |
| LogP | -4.6 |
| Topological Polar Surface Area | 243.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 8 |
| Exact Mass | 558.1996 |
| Heavy Atoms | 38 |
| Complexity | 907.0 |
Chemical Identifiers
| CAS Number | 158274-98-7 |
|---|---|
| SMILES | CCC1(C(NC(=O)C(NC(=O)C(C(C2=CC(=C(C=C2S(=O)CCO)O)O1)O)NC)C)C(=O)NCC(=O)O)C |
| InChIKey | GLUWKRSBTMPQNR-UHFFFAOYSA-N |
Product Overview
Ustiloxin C (CAS 158274-98-7), with molecular formula C23H34N4O10S and molecular weight 558.20 g/mol. IUPAC: 2-[[3-ethyl-11,15-dihydroxy-13-(2-hydroxyethylsulfinyl)-3,7-dimethyl-10-(methylamino)-6,9-dioxo-2-oxa-5,8-diazabicyclo[10.3.1]hexadeca-1(15),12(16),13-triene-4-carbonyl]amino]acetic acid.
Chemical Property Profile of Ustiloxin C
Property Insights of Ustiloxin C
The XLogP value of -4.6 indicates that Ustiloxin C is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 243.0 Ų indicates high polarity, suggesting Ustiloxin C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ustiloxin C has 8 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ustiloxin C?
The CAS number of Ustiloxin C is 158274-98-7.
What is the molecular formula of Ustiloxin C?
The molecular formula of Ustiloxin C is C23H34N4O10S.
What is the molecular weight of Ustiloxin C?
The molecular weight of Ustiloxin C is 558.20 g/mol.
Where can I buy Ustiloxin C?
You can request a quote for Ustiloxin C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ustiloxin C?
Yes, KEHONG BIO provides custom synthesis services for Ustiloxin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.