BIAdb Oxopurpureine 2876
From DrugPedia: A Wikipedia for Drug discovery
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[http://crdd.osdd.net/raghava/biadb/detail.php?id=2876 Link to BIAdb Database] | [http://crdd.osdd.net/raghava/biadb/detail.php?id=2876 Link to BIAdb Database] | ||
| + | [[Category:BIAdb]] | ||
Current revision
| BIAdb Oxopurpureine 2876
| |
| Systematic (IUPAC) name | |
| N/A | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C21H19NO6 |
| Mol. mass | 381.37866 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
Contents |
[edit] Description
[edit] Source
Annona purpurea
[edit] Function
Antiplatelet
[edit] General Properties
*Molecular Weight
381.37866
*Exact Mass
381.121237
*Molecular Formula
C21H19NO6
*IUPAC NAME
N/A
*Canonical Smiles
COC1=C(C=C2C(=C1)C3=C(C(=C(C4=C3C(=NC=C4)C2=O)OC)OC)OC)OC
*Isomeric Smiles
N/A
*XLogP
3.4
*Hydrogen bond donor
0
*Hydrogen bond acceptor
7
*Rotational Bond Count
5
*Topological Polar Surface Area
76.1
