BIAdb Bicuculline 1532
From DrugPedia: A Wikipedia for Drug discovery
| BIAdb Bicuculline 1532
| |
| Systematic (IUPAC) name | |
| (6R)-6-[(5S)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-6H-furo[4,3-g][1,3]benzodioxol-8-one | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C20H17NO6 |
| Mol. mass | 367.35208 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
Contents |
[edit] Description
[edit] Source
Corydalis thalictrifolia
[edit] Function
GABA-A antagonist
[edit] General Properties
*Molecular Weight
367.35208
*Exact Mass
367.105587
*Molecular Formula
C20H17NO6
*IUPAC NAME
(6R)-6-[(5S)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-6H-furo[4,3-g][1,3]benzodioxol-8-one
*Canonical Smiles
CN1CCC2=CC3=C(C=C2C1C4C5=C(C6=C(C=C5)OCO6)C(=O)O4)OCO3
*Isomeric Smiles
CN1CCC2=CC3=C(C=C2[C@H]1[C@H]4C5=C(C6=C(C=C5)OCO6)C(=O)O4)OCO3
*XLogP
2.6
*Hydrogen bond donor
0
*Hydrogen bond acceptor
7
*Rotational Bond Count
1
*Topological Polar Surface Area
66.5
