Papaverinol
From DrugPedia: A Wikipedia for Drug discovery
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==Description== | ==Description== | ||
| - | degradation product of papaverine | + | This alkaloid containing an unsaturated heterocyclic ring.Papaverinol is a degradation product of papaverine. |
==General Properties== | ==General Properties== | ||
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[http://crdd.osdd.net/raghava/biadb/detail.php?id=1135 Link to BIAdb Database] | [http://crdd.osdd.net/raghava/biadb/detail.php?id=1135 Link to BIAdb Database] | ||
| + | [[Category:BIAdb_old]] | ||
Current revision
| Papaverinol
| |
| Systematic (IUPAC) name | |
| (R)-(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methanol | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C20H21NO5 |
| Mol. mass | 355.38444 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
[edit] Description
This alkaloid containing an unsaturated heterocyclic ring.Papaverinol is a degradation product of papaverine.
[edit] General Properties
*Molecular Weight
355.38444
*Molecular Formula
C20H21NO5
*IUPAC NAME
(R)-(6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methanol
*Canonical Smiles
COC1=C(C=C(C=C1)C(C2=NC=CC3=CC(=C(C=C32)OC)OC)O)OC
*Isomeric Smiles
COC1=C(C=C(C=C1)[C@H](C2=NC=CC3=CC(=C(C=C32)OC)OC)O)OC
*XLogP
2
*Topological Polar Surface Area
70
