TL;DR: Palmarumycin C13 (CAS 155866-40-3) is a chemical compound with molecular formula C20H14O7 and molecular weight 366.07394 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2'S,3'R,5'R,11'S)-2',11'-dihydroxyspiro[2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene-3,6'-4,12-dioxatetracyclo[5.4.1.01,7.03,5]dodec-9-ene]-8'-one
Also Known As: Palmarumycin C13, Cladospirone bisepoxide, Sch 53514, KST-1A2387, (1ar,6s,7s,7ar)-6,7-dihydroxy-7,7a-dihydro-1ah-spiro[2a,6a-epoxynaphtho[2,3-b]oxirene-2,2'-naphtho[1,8-de][1,3]dioxin]-3(6h)-one
| Molecular Formula | C20H14O7 |
| Molecular Weight | 366.07394 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 366.07394 Da |
| Heavy Atoms | 27 |
| Complexity | 745.0 |
| SMILES | C1=CC2=C3C(=C1)OC4([C@H]5[C@H](O5)[C@@H](C67C4(O6)C(=O)C=C[C@@H]7O)O)OC3=CC=C2 |
| InChIKey | AUWGMDYISSBOED-TUSOLQNESA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Palmarumycin C13. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Palmarumycin C13. Following Lipinski's Rule of Five, Palmarumycin C13 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Palmarumycin C13 is 155866-40-3.
The molecular formula of Palmarumycin C13 is C20H14O7.
The molecular weight of Palmarumycin C13 is 366.07394 g/mol.
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