Inostamycin
TL;DR: Inostamycin (CAS 13022-42-9) is a chemical compound with molecular formula C38H68O11 and molecular weight 700.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3S)-5-ethyl-6-[(2S,3S)-6-[(2S,3S)-5-[(5R)-5-ethyl-2-hydroxy-5-(1-hydroxybutyl)-3-methyloxolan-2-yl]-3,5-dimethyloxolan-2-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-2,4-dihydroxy-3-methyloxan-2-yl]butanoic acid
Also Known As: Inostamycin, Inostamycin A, 129905-10-8 (as free form), NCI60_012863, 2-[(3S)-5-ethyl-6-[(2S,3S)-6-[(2S,3S)-5-[(5R)-5-ethyl-2-hydroxy-5-(1-hydroxybutyl)-3-methyloxolan-2-yl]-3,5-dimethyloxolan-2-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-2,4-dihydroxy-3-methyloxan-2-yl]butanoic acid
| Molecular Formula | C38H68O11 |
|---|---|
| Molecular Weight | 700.48 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 183.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 16 |
| Exact Mass | 700.47614 |
| Heavy Atoms | 49 |
| Complexity | 1130.0 |
Chemical Identifiers
| CAS Number | 13022-42-9 |
|---|---|
| SMILES | CCCC([C@]1(CC(C(O1)(C2(C[C@@H]([C@H](O2)C(CC)C(=O)C(C)[C@H]([C@H](C)C3C(C([C@@H](C(O3)(C(CC)C(=O)O)O)C)O)CC)O)C)C)O)C)CC)O |
| InChIKey | NZJHONRWXITMMC-RBLAFODUSA-N |
Product Overview
Inostamycin (CAS 13022-42-9), with molecular formula C38H68O11 and molecular weight 700.48 g/mol. IUPAC: 2-[(3S)-5-ethyl-6-[(2S,3S)-6-[(2S,3S)-5-[(5R)-5-ethyl-2-hydroxy-5-(1-hydroxybutyl)-3-methyloxolan-2-yl]-3,5-dimethyloxolan-2-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-2,4-dihydroxy-3-methyloxan-2-yl]butanoic acid.
Chemical Property Profile of Inostamycin
Property Insights of Inostamycin
The XLogP value of 5.4 indicates that Inostamycin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 183.0 Ų indicates high polarity, suggesting Inostamycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Inostamycin 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 Inostamycin?
The CAS number of Inostamycin is 13022-42-9.
What is the molecular formula of Inostamycin?
The molecular formula of Inostamycin is C38H68O11.
What is the molecular weight of Inostamycin?
The molecular weight of Inostamycin is 700.48 g/mol.
Where can I buy Inostamycin?
You can request a quote for Inostamycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Inostamycin?
Yes, KEHONG BIO provides custom synthesis services for Inostamycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.