Showing Metabocard for monacolin J (BASm0006688)
| Common Name | Monacolin j |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C19H28O4 |
| Average Mass | 320.42900 |
| Monoisotopic Mass | 320.19876 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | C[C@H]1C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@H]2[C@@H](O)C1 |
| InChI Identifier | InChI=1S/C19H28O4/c1-11-7-13-4-3-12(2)16(19(13)17(21)8-11)6-5-15-9-14(20)10-18(22)23-15/h3-4,7,11-12,14-17,19-21H,5-6,8-10H2,1-2H3/t11-,12-,14+,15+,16-,17-,19-/m0/s1 |
| InChI Key | ZDFOBOYQVYMVCW-IRUSZSJRSA-N |
| CHEBI ID | CHEBI:79034 |
| MiMeDB ID | MMDBc0056087 |
| State | Expected Solid |
| 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 |