Showing Metabocard for 3beta-hydroxy-15,16-epoxydolabrene (BASm0009802)
| Common Name | 3beta-hydroxy-15,16-epoxydolabrene |
|---|---|
| Description | A tricyclic diterpenoid that is 15,16-epoxydolabrene in which the pro-S hydrogen at position 3 has been replaced by a hydroxy group. |
| Structure | |
| Molecular Formula | C20H32O2 |
| Average Mass | 304.46800 |
| Monoisotopic Mass | Not Available |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | C=C1[C@@H](O)CC[C@H]2[C@]3(C)CC[C@](C)(C4CO4)C[C@H]3CC[C@]12C |
| InChI Identifier | InChI=1S/C20H32O2/c1-13-15(21)5-6-16-19(13,3)8-7-14-11-18(2,17-12-22-17)9-10-20(14,16)4/h14-17,21H,1,5-12H2,2-4H3/t14-,15+,16-,17?,18+,19-,20-/m1/s1 |
| InChI Key | JPGKQPWEFBWKDM-XVMBTQODSA-N |
| CHEBI ID | CHEBI:141820 |
| 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 | 0 |
| Polarizability | Not Available |