Mycestericin A
TL;DR: Mycestericin A (CAS 128440-98-2) is a chemical compound with molecular formula C21H39NO6 and molecular weight 401.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4R,14R)-2-amino-3,4,14-trihydroxy-2-(hydroxymethyl)icosa-6,12-dienoic acid
Also Known As: Mycestericin A, 2-Amino-3,4,14-trihydroxy-2-hydroxymethyleicosa-6,12-dienoic acid, (2S,3R,4R,14R)-2-Amino-3,4,14-trihydroxy-2-(hydroxymethyl)icosa-6,12-dienoic acid, 6,12-Eicosadienoicacid, 2-amino-3,4,14-trihydroxy-2-(hydroxymethyl)-, (2S,3R,4R,6E,12E,14R)-
| Molecular Formula | C21H39NO6 |
|---|---|
| Molecular Weight | 401.28 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 17 |
| Exact Mass | 401.27774 |
| Heavy Atoms | 28 |
| Complexity | 468.0 |
Chemical Identifiers
| CAS Number | 128440-98-2 |
|---|---|
| SMILES | CCCCCC[C@H](C=CCCCCC=CC[C@H]([C@@H]([C@@](CO)(C(=O)O)N)O)O)O |
| InChIKey | SPUGTKTYKGAGRY-BNDYYXHWSA-N |
Product Overview
Mycestericin A (CAS 128440-98-2), with molecular formula C21H39NO6 and molecular weight 401.28 g/mol. IUPAC: (2S,3R,4R,14R)-2-amino-3,4,14-trihydroxy-2-(hydroxymethyl)icosa-6,12-dienoic acid.
Chemical Property Profile of Mycestericin A
Property Insights of Mycestericin A
The XLogP value of -0.1 indicates that Mycestericin A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 144.0 Ų indicates high polarity, suggesting Mycestericin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Mycestericin A has 6 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Mycestericin A?
The CAS number of Mycestericin A is 128440-98-2.
What is the molecular formula of Mycestericin A?
The molecular formula of Mycestericin A is C21H39NO6.
What is the molecular weight of Mycestericin A?
The molecular weight of Mycestericin A is 401.28 g/mol.
Where can I buy Mycestericin A?
You can request a quote for Mycestericin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mycestericin A?
Yes, KEHONG BIO provides custom synthesis services for Mycestericin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.