Hetisan-6,11,15-triol
(1S,5S,13S,16R,17S,18R,19R)-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.01,8.05,17.07,16.09,14.014,18]nonadecane-13,16,19-triol
Also Known As: Pseudokobusine|Hetisan-6,11,15-triol|methyl(methylene)[?]triol|Hetisan-6,11-beta,15-beta-triol|Hetisan-6,11,15-triol, (11beta,15beta)-|Hetisan-6,11,15-triol, (11-beta,15-alpha)-|4-21-00-02599 (Beilstein Handbook Reference)|Hetisan-6,11,15-triol, (4b,5a,9a,10b,11a,15a)-|(20xi)-4beta,5alpha,9alpha,10beta,14xi,21xi-Hetisan-6,11beta,15beta-triol
| Molecular Formula | C20H27NO3 |
|---|---|
| Molecular Weight | 329.1991 g/mol |
| LogP | 1.11 |
| Topological Polar Surface Area | 63.93 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 329.1991 |
| Heavy Atoms | 24 |
| Complexity | 723.7 |
Chemical Identifiers
| CAS Number | 27901-01-5 |
|---|---|
| SMILES | C[C@]12CCC[C@@]34[C@H]1[C@@]5(CC67[C@@H]3[C@@H](C(CC6C4N5C2)C(=C)[C@@H]7O)O)O |
Product Overview
Hetisan-6,11,15-triol (CAS 27901-01-5), with molecular formula C20H27NO3 and molecular weight 329.1991 g/mol. IUPAC: (1S,5S,13S,16R,17S,18R,19R)-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.01,8.05,17.07,16.09,14.014,18]nonadecane-13,16,19-triol.
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