Thymosterin
[1,3-dihydroxy-10,13-dimethyl-17-[1-(4,5,5-trimethyloxolan-2-yl)ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-12-yl] acetate
Also Known As: Thymosterin|Thymosterine|alumane,nickel(4:3)|[1,3-dihydroxy-10,13-dimethyl-17-[1-(4,5,5-trimethyloxolan-2-yl)ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-12-yl] acetate|1,3-Dihydroxy-22,25-epoxyergost-5-en-12-yl acetate|Ergost-5-ene-1,3,12-triol, 22,25-epoxy-, 12-acetate, (1beta,3beta,12beta,24.xi.)-
| Molecular Formula | C30H48O5 |
|---|---|
| Molecular Weight | 488.3502 g/mol |
| LogP | 5.2784 |
| Topological Polar Surface Area | 75.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 488.3502 |
| Monoisotopic Mass | 488.3502 |
| Heavy Atoms | 35 |
| Complexity | 879.97266 |
Chemical Identifiers
| CAS Number | 39379-76-5 |
|---|---|
| SMILES | CC1CC(OC1(C)C)C(C)C2CCC3C2(C(CC4C3CC=C5C4(C(CC(C5)O)O)C)OC(=O)C)C |
Product Overview
Thymosterin (CAS 39379-76-5), with molecular formula C30H48O5 and molecular weight 488.3502 g/mol. IUPAC: [1,3-dihydroxy-10,13-dimethyl-17-[1-(4,5,5-trimethyloxolan-2-yl)ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-12-yl] acetate.
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