4-Aminoestra-1,3,5(10)-triene-3,17beta-diol
(8R,9S,13S,14S,17S)-4-amino-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
Also Known As: 4-amino-estradiol|4-Aminoestra-1,3,5(10)-triene-3,17beta-diol|4-aminoestra-1,3,5(10)-triene-3,17|A-diol|(8R,9S,13S,14S,17S)-4-amino-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol|4-amino-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclope|(1S,3aS,3bR,9bS,11aS)-6-amino-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-diol|4-amino-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
| Molecular Formula | C18H25NO2 |
|---|---|
| Molecular Weight | 287.18854 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 287.18854 |
| Monoisotopic Mass | 287.18854 |
| Heavy Atoms | 21 |
| Complexity | 414.0 |
Chemical Identifiers
| CAS Number | 6962-93-2 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4N)O |
| InChIKey | DIDANTCTDBQPRP-ZHIYBZGJSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Aminoestra-1,3,5(10)-triene-3,17beta-diol (CAS 6962-93-2), with molecular formula C18H25NO2 and molecular weight 287.18854 g/mol. IUPAC: (8R,9S,13S,14S,17S)-4-amino-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol.
4-Aminoestra-1,3,5(10)-triene-3,17beta-diol is a custom synthesis product. We offer services from milligram to kilogram scale.
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