BIAdb LS-21480 2559

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BIAdb LS-21480 2559
Systematic (IUPAC) name
N/A
Identifiers
CAS number	?
ATC code	?
PubChem	53067
Chemical data
Formula	C22H28ClNO5
Mol. mass	421.91442
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

Contents 1 Description 2 Source 3 Function 4 General Properties 5 External Links

[edit] Description

[edit] Source

N/A

[edit] Function

Unknown

[edit] General Properties

*Molecular Weight

421.91442

*Exact Mass

421.165601

*Molecular Formula

C₂₂H₂₈ClNO₅

*IUPAC NAME

N/A

*Canonical Smiles

C[NH+]1CCC2=C(C(=C(C3=C2C1CC4=CC(=C(C=C43)OC)OC)OC)OC)CO.[Cl-]

*Isomeric Smiles

C[NH+]1CCC2=C(C(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)OC)OC)OC)CO.[Cl-]

*XLogP

N/A

*Hydrogen bond donor

2

*Hydrogen bond acceptor

6

*Rotational Bond Count

5

*Topological Polar Surface Area

61.6

[edit] External Links

• Pubchem

Link to BIAdb Database