(+)-Armepavine (-)-mandelate
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[http://crdd.osdd.net/raghava/biadb/detail.php?id=1544 Link to BIAdb Database] | [http://crdd.osdd.net/raghava/biadb/detail.php?id=1544 Link to BIAdb Database] | ||
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Current revision
(+)-Armepavine (-)-mandelate
| |
Systematic (IUPAC) name | |
4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenol; 2-hydroxy-2-phenylaceticacid | |
Identifiers | |
CAS number | ? |
ATC code | ? |
PubChem | |
Chemical data | |
Formula | C27H31NO6 |
Mol. mass | 465.53814 |
SMILES | & |
Pharmacokinetic data | |
Bioavailability | ? |
Metabolism | ? |
Half life | ? |
Excretion | ? |
Therapeutic considerations | |
Pregnancy cat. |
? |
Legal status | |
Routes | ? |
[edit] Description
[edit] General Properties
*Molecular Weight
465.53814
*Molecular Formula
C27H31NO6
*IUPAC NAME
4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenol; 2-hydroxy-2-phenylaceticacid
*Canonical Smiles
CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)OC)OC.C1=CC=C(C=C1)C(C(=O)O)O
*Isomeric Smiles
N/A
*XLogP
N/A
*Topological Polar Surface Area
99.5