TL;DR: Gitoformatum (CAS 10176-39-3) is a chemical compound with molecular formula C46H64O19 and molecular weight 920.4042 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-[5-(4,5-diformyloxy-6-methyloxan-2-yl)oxy-4-formyloxy-6-methyloxan-2-yl]oxy-6-[[16-formyloxy-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-2-methyloxan-4-yl] formate
Also Known As: Gitoformate, Formiloxin, Formiloxine, Gitoformatum, Pentaformylgitoxin
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C46H64O19 |
| Molecular Weight | 920.4042 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 233.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 17 |
| Exact Mass | 920.4042 Da |
| Heavy Atoms | 65 |
| Complexity | 1780.0 |
| SMILES | CC1C(C(CC(O1)OC2C(OC(CC2OC=O)OC3C(OC(CC3OC=O)OC4CCC5(C(C4)CCC6C5CCC7(C6(CC(C7C8=CC(=O)OC8)OC=O)O)C)C)C)C)OC=O)OC=O |
| InChIKey | DOMHWKQEPDYUQX-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that Gitoformatum is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 233.0 Ų indicates high polarity, suggesting Gitoformatum may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Gitoformatum has 1 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Gitoformatum is 10176-39-3.
The molecular formula of Gitoformatum is C46H64O19.
The molecular weight of Gitoformatum is 920.4042 g/mol.
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