BIAdb Berberine 1347
From DrugPedia: A Wikipedia for Drug discovery
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[http://crdd.osdd.net/raghava/biadb/detail.php?id=1347 Link to BIAdb Database] | [http://crdd.osdd.net/raghava/biadb/detail.php?id=1347 Link to BIAdb Database] | ||
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Current revision
| BIAdb Berberine 1347
| |
| Systematic (IUPAC) name | |
| N/A | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C20H18NO4+ |
| Mol. mass | 336.36122 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
Contents |
[edit] Description
[edit] Source
Coptis chinensis
[edit] Function
Antiparasitic
[edit] General Properties
*Molecular Weight
336.36122
*Exact Mass
336.123583
*Molecular Formula
C20H18NO4+
*IUPAC NAME
N/A
*Canonical Smiles
COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC
*Isomeric Smiles
N/A
*XLogP
3.6
*Hydrogen bond donor
0
*Hydrogen bond acceptor
4
*Rotational Bond Count
2
*Topological Polar Surface Area
40.8
