TL;DR: Desertomycin D (CAS 143629-44-1) is a chemical compound with molecular formula C61H106O22 and molecular weight 1190.7175 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8,10,16,20,24,26,28,30,32,34,36,38-dodecahydroxy-42-[(1R)-1-(5-hydroxyoxolan-2-yl)ethyl]-3,7,9,15,19,21,31,33-octamethyl-23-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-oxacyclodotetraconta-3,13,17,21,39-pentaen-2-one
Also Known As: Desertomycin D, Desertomycin B, (3Z,17E,21E,39E)-8,10,16,20,24,26,28,30,32,34,36,38-dodecahydroxy-42-[(1R)-1-(5-hydroxyoxolan-2-yl)ethyl]-3,7,9,15,19,21,31,33-octamethyl-23-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-oxacyclodotetraconta-3,13,17,21,39-pentaen-2-one, 8,10,16,20,24,26,28,30,32,34,36,38-dodecahydroxy-42-[(1R)-1-(5-hydroxyoxolan-2-yl)ethyl]-3,7,9,15,19,21,31,33-octamethyl-23-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-oxacyclodotetraconta-3,13,17,21,39-pentaen-2-one, Oxacyclodotetraconta-3,13,17,21,39-pentaen-2-one, 8,10,16,20,24,26,28,30,32,34,26,28-dodecahydroxy-23-(alpha-D-mannopyranosyloxy)-3,7,9,15,19,21,31,33-octamethyl-42-((1R)-1-((2R)-tetrahydro-5-hydroxy-2-furanyl)ethyl)-, (3E,7S,8R,9S,10S,13E,15S,16S,17E,19S,20R,21E,23S,24R,26S,28S,30S,31S,32R,33S,34R,36S,38S,39E,42S)-
| Molecular Formula | C61H106O22 |
| Molecular Weight | 1190.7175 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 398.0 Ų |
| Hydrogen Bond Donors | 17 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 5 |
| Exact Mass | 1190.7175 Da |
| Heavy Atoms | 83 |
| Complexity | 2000.0 |
| SMILES | CC1CCC=C(C(=O)OC(CC=CC(CC(CC(C(C(C(C(CC(CC(CC(C(C=C(C(C(C=CC(C(C=CCCC(C(C1O)C)O)C)O)C)O)C)O[C@@H]2[C@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)O)O)C)O)C)O)O)O)[C@H](C)C3CCC(O3)O)C |
| InChIKey | ZQGMDHCZCLGAKC-KRJCFVKLSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Desertomycin D. The TPSA of 398.0 Ų indicates high polarity, suggesting Desertomycin D may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Desertomycin D has 17 hydrogen bond donor(s) and 22 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Desertomycin D is 143629-44-1.
The molecular formula of Desertomycin D is C61H106O22.
The molecular weight of Desertomycin D is 1190.7175 g/mol.
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