Showing Metabocard for 15alpha-hydroxyestrone (BASm0007653)
| Common Name | 15alpha-hydroxyestrone |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C18H22O3 |
| Average Mass | 286.37100 |
| Monoisotopic Mass | 286.15689 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1[C@@H](O)CC2=O |
| InChI Identifier | InChI=1S/C18H22O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)17(18)15(20)9-16(18)21/h3,5,8,13-15,17,19-20H,2,4,6-7,9H2,1H3/t13?,14?,15?,17?,18-/m1/s1 |
| InChI Key | FDFNTZDUOBCJMD-SOYGFASJSA-N |
| CHEBI ID | CHEBI:87618 |
| HMDB ID | HMDB0154987 |
| State | Not Available |
| Water Solubility | Not Available |
| logS | Not Available |
| pKa (Strongest Acidic) | Not Available |
| pKa (Strongest Basic) | Not Available |
| Hydrogen Acceptor Count | Not Available |
| Hydrogen Donor Count | Not Available |
| Rotatable Bond Count | Not Available |
| Physiological Charge | Not Available |
| Formal Charge | Not Available |
| Polarizability | Not Available |