BIAdb Magnoflorine styphnate 2673

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BIAdb Magnoflorine styphnate 2673
Systematic (IUPAC) name
N/A
Identifiers
CAS number  ?
ATC code  ?
PubChem 5748540
Chemical data
Formula C26H26N4O12
Mol. mass 586.50424
SMILES eMolecules & PubChem
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

586.50424

*Exact Mass

586.154722

*Molecular Formula

C26H26N4O12

*IUPAC NAME

N/A

*Canonical Smiles

C[N+]1(CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)O)O)OC)C.C1=C(C(=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[O-])[N+](=O)[O-]

*Isomeric Smiles

C[N+]1(CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=C(C=C4)OC)O)O)OC)C.C1=C(C(=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[O-])[N+](=O)[O-]

*XLogP

N/A

*Hydrogen bond donor

3

*Hydrogen bond acceptor

12

*Rotational Bond Count

2

*Topological Polar Surface Area

232

[edit] External Links

Link to BIAdb Database