BIAdb THEBAINE PICRATE 3425
From DrugPedia: A Wikipedia for Drug discovery
| BIAdb THEBAINE PICRATE 3425
| |
| Systematic (IUPAC) name | |
| N/A | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C25H24N4O10 |
| Mol. mass | 540.47886 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
Contents |
[edit] Description
[edit] Source
N/A
[edit] Function
Unknown
[edit] General Properties
*Molecular Weight
540.47886
*Exact Mass
540.149243
*Molecular Formula
C25H24N4O10
*IUPAC NAME
N/A
*Canonical Smiles
C[NH+]1CCC23C4C(=CC=C2C1CC5=C3C(=C(C=C5)OC)O4)OC.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]
*Isomeric Smiles
C[NH+]1CC[C@]23C4C(=CC=C2[C@H]1CC5=C3C(=C(C=C5)OC)O4)OC.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]
*XLogP
N/A
*Hydrogen bond donor
1
*Hydrogen bond acceptor
10
*Rotational Bond Count
2
*Topological Polar Surface Area
185
