Thalifaberidine
From DrugPedia: A Wikipedia for Drug discovery
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==Description== | ==Description== | ||
an aporphine-benzoylisoquinoline alkaloid; from Thalictrum faberi; structure given in first source | an aporphine-benzoylisoquinoline alkaloid; from Thalictrum faberi; structure given in first source | ||
| + | Performed cytotoxic activity against several human cancer cell lines, as well as antimalarial activity. | ||
==General Properties== | ==General Properties== | ||
Revision as of 04:28, 4 May 2009
| Thalifaberidine
| |
| Systematic (IUPAC) name | |
| N/A | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C39H44N2O8 |
| Mol. mass | 668.77526 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
Description
an aporphine-benzoylisoquinoline alkaloid; from Thalictrum faberi; structure given in first source Performed cytotoxic activity against several human cancer cell lines, as well as antimalarial activity.
General Properties
*Molecular Weight
668.77526
*Molecular Formula
C39H44N2O8
*IUPAC NAME
N/A
*Canonical Smiles
CN1CCC2=C(C(=C(C3=C2C1CC4=C(C(=C(C=C43)OC)O)OC5=CC=C(C=C5)CC6C7=CC(=C(C=C7CCN6C)O)OC)OC)OC)OC
*Isomeric Smiles
CN1CCC2=C(C(=C(C3=C2[C@@H]1CC4=C(C(=C(C=C43)OC)O)OC5=CC=C(C=C5)C[C@H]6C7=CC(=C(C=C7CCN6C)O)OC)OC)OC)OC
*XLogP
4.9
*Topological Polar Surface Area
102
