Armepavine
From DrugPedia: A Wikipedia for Drug discovery
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[http://crdd.osdd.net/raghava/biadb/detail.php?id=2138 Link to BIAdb Database] | [http://crdd.osdd.net/raghava/biadb/detail.php?id=2138 Link to BIAdb Database] | ||
+ | [[Category:BIAdb_old]] |
Current revision
Armepavine
| |
Systematic (IUPAC) name | |
4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenol | |
Identifiers | |
CAS number | ? |
ATC code | ? |
PubChem | |
ChemSpider | |
Chemical data | |
Formula | C19H23NO3 |
Mol. mass | 313.39082 |
SMILES | & |
Synonyms | Evoeuropine |
Physical data | |
Melt. point | 144-145 °C |
Pharmacokinetic data | |
Bioavailability | ? |
Metabolism | ? |
Half life | ? |
Excretion | ? |
Therapeutic considerations | |
Pregnancy cat. |
? |
Legal status | |
Routes | ? |
[edit] Description
reticuline-like; RN given refers to cpd without isomeric designation
[edit] General Properties
*Molecular Weight
313.39082
*Molecular Formula
C19H23NO3
*IUPAC NAME
4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenol
*Canonical Smiles
CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)OC)OC
*Isomeric Smiles CN1CCC2=CC(=C(C=C2[C@@H]1CC3=CC=C(C=C3)O)OC)OC
*XLogP
2.7
*Topological Polar Surface Area
41.9