(-)-Roehybridine
From DrugPedia: A Wikipedia for Drug discovery
| (-)-Roehybridine
| |
| Systematic (IUPAC) name | |
| N/A | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C31H39N3O5 |
| Mol. mass | 533.65846 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
[edit] Description
[edit] General Properties
*Molecular Weight
533.65846
*Molecular Formula
C31H39N3O5
*IUPAC NAME
N/A
*Canonical Smiles
CN1CCC2=CC(=C(C3=C2C1CC34CCC5(C(C4)OC)C6=C(CCN5)C7=CC(=C(C=C7N6)OC)OC)O)OC
*Isomeric Smiles
CN1CCC2=CC(=C(C3=C2C1C[C@@]34CC[C@@]5([C@H](C4)OC)C6=C(CCN5)C7=CC(=C(C=C7N6)OC)OC)O)OC
*XLogP
2.4
*Topological Polar Surface Area
88.2
