BIAdb Anonaine 1172
From DrugPedia: A Wikipedia for Drug discovery
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[http://crdd.osdd.net/raghava/biadb/detail.php?id=1172 Link to BIAdb Database] | [http://crdd.osdd.net/raghava/biadb/detail.php?id=1172 Link to BIAdb Database] | ||
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Current revision
| BIAdb Anonaine 1172
| |
| Systematic (IUPAC) name | |
| N/A | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C17H15NO2 |
| Mol. mass | 265.3065 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
Contents |
[edit] Description
[edit] Source
Nelumbo nucifera
[edit] Function
Antimicrobial
[edit] General Properties
*Molecular Weight
265.3065
*Exact Mass
265.110279
*Molecular Formula
C17H15NO2
*IUPAC NAME
N/A
*Canonical Smiles
C1CNC2CC3=CC=CC=C3C4=C2C1=CC5=C4OCO5
*Isomeric Smiles
C1CN[C@@H]2CC3=CC=CC=C3C4=C2C1=CC5=C4OCO5
*XLogP
2.8
*Hydrogen bond donor
1
*Hydrogen bond acceptor
3
*Rotational Bond Count
0
*Topological Polar Surface Area
30.5
