NCGC00180968-01

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Revision as of 05:49, 23 April 2009

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NCGC00180968-01
Systematic (IUPAC) name
N/A
Identifiers
CAS number	?
ATC code	?
PubChem	24871298
Chemical data
Formula	C37H44Cl2N2O7
Mol. mass	699.66046
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

Description

General Properties

*Molecular Weight

699.66046

*Molecular Formula

C₃₇H₄₄Cl₂N₂O₇

*IUPAC NAME

N/A

*Canonical Smiles

CN1CCC2=CC(=C3C=C2C1CC4=CC(=CC=C4)OC5=C6C(CC7=CC(=C(C=C7)O)O3)[N+](CCC6=CC(=C5O)OC)(C)C)OC.O.Cl.[Cl-]

*Isomeric Smiles

CN1CCC2=CC(=C3C=C2[C@@H]1CC4=CC(=CC=C4)OC5=C6[C@@H](CC7=CC(=C(C=C7)O)O3)[N+](CCC6=CC(=C5O)OC)(C)C)OC.O.Cl.[Cl-]

*XLogP

N/A

*Topological Polar Surface Area

81.6

External Links

• Pubchem

Link to BIAdb Database