Tiacumicin C
TL;DR: Tiacumicin C (CAS 106008-70-2) is a chemical compound with molecular formula C52H74Cl2O18 and molecular weight 1056.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-[[(3Z,5E,9E,13E,15E)-12-[4,5-dihydroxy-6,6-dimethyl-3-(2-methylpropanoyloxy)oxan-2-yl]oxy-11-ethyl-8-hydroxy-18-(1-hydroxyethyl)-9,13,15-trimethyl-2-oxo-1-oxacyclooctadeca-3,5,9,13,15-pentaen-3-yl]methoxy]-4-hydroxy-5-methoxy-2-methyloxan-3-yl] 3,5-dichloro-2-ethyl-4,6-dihydroxybenzoate
Also Known As: Tiacumicin C, Clostomicin B2, Clostomycin B2, Lipiarmycin B3, Fidaxomicin
| Molecular Formula | C52H74Cl2O18 |
|---|---|
| Molecular Weight | 1056.43 g/mol |
| LogP | 6.2344 |
| Topological Polar Surface Area | 266.66 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 13 |
| Exact Mass | 1056.4252 |
| Heavy Atoms | 72 |
| Complexity | 2216.025 |
Chemical Identifiers
| CAS Number | 106008-70-2 |
|---|---|
| SMILES | CCC1/C=C(/C(C/C=C/C=C(\C(=O)OC(C/C=C(/C=C(/C1OC2C(C(C(C(O2)(C)C)O)O)OC(=O)C(C)C)\C)\C)C(C)O)/COC3C(C(C(C(O3)C)OC(=O)C4=C(C(=C(C(=C4O)Cl)O)Cl)CC)O)OC)O)\C |
Product Overview
Tiacumicin C (CAS 106008-70-2), with molecular formula C52H74Cl2O18 and molecular weight 1056.43 g/mol. IUPAC: [6-[[(3Z,5E,9E,13E,15E)-12-[4,5-dihydroxy-6,6-dimethyl-3-(2-methylpropanoyloxy)oxan-2-yl]oxy-11-ethyl-8-hydroxy-18-(1-hydroxyethyl)-9,13,15-trimethyl-2-oxo-1-oxacyclooctadeca-3,5,9,13,15-pentaen-3-yl]methoxy]-4-hydroxy-5-methoxy-2-methyloxan-3-yl] 3,5-dichloro-2-ethyl-4,6-dihydroxybenzoate.
Chemical Property Profile of Tiacumicin C
Property Insights of Tiacumicin C
The XLogP value of 6.2344 indicates that Tiacumicin C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 266.66 Ų indicates high polarity, suggesting Tiacumicin C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tiacumicin C has 7 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tiacumicin C?
The CAS number of Tiacumicin C is 106008-70-2.
What is the molecular formula of Tiacumicin C?
The molecular formula of Tiacumicin C is C52H74Cl2O18.
What is the molecular weight of Tiacumicin C?
The molecular weight of Tiacumicin C is 1056.43 g/mol.
Where can I buy Tiacumicin C?
You can request a quote for Tiacumicin C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tiacumicin C?
Yes, KEHONG BIO provides custom synthesis services for Tiacumicin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.