Dammarenediol
(3S,5R,8R,9R,10R,14R)-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Also Known As: Dammarenediol|Dammarenediol II|Dammar-24-ene-3beta,20-diol|Dammar-24-ene-3,20-diol|3beta-Dammar-24-ene-3,20-diol|KST-1A1452|Dammar-24-ene-3,20-diol, (3beta)-|(20S)-Dammar-24-ene-3 beta,20-diol|Dammar-24-ene-3,20-diol, (3.beta.)-|(13xi,17xi)-Dammar-24-ene-3beta,20-diol|(3|A,13|I,17|I)-dammar-24-ene-3,20-diol|(3S,5R,8R,9R,10R,14R)-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol|(3S,5R,8R,9R,10R,14R)-17-((S)-1-Hydroxy-1,5-dimethyl-hex-4-enyl)-4,4,8,10,14-pentamethyl-hexadecahydro-cyclopenta[a]phenanthren-3-ol|(3S,5R,8R,9R,10R,14R)-17-[(1S)-1-hydroxy-1,5-dimethyl-hex-4-enyl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol|(3S,5R,8R,9R,10R,14R)-4,4,8,10,14-pentamethyl-17-[(2S)-6-methyl-2-oxidanyl-hept-5-en-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
| Molecular Formula | C30H52O2 |
|---|---|
| Molecular Weight | 444.39673 g/mol |
| LogP | 7.53 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 444.39673 |
| Heavy Atoms | 32 |
| Complexity | 745.9 |
Chemical Identifiers
| CAS Number | 14351-29-2 |
|---|---|
| SMILES | CC(=CCC[C@@](C)(C1CC[C@@]2(C1CC[C@H]3[C@]2(CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C)O)C |
Product Overview
Dammarenediol (CAS 14351-29-2), with molecular formula C30H52O2 and molecular weight 444.39673 g/mol. IUPAC: (3S,5R,8R,9R,10R,14R)-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol.
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