BIAdb NSC274893 2825

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BIAdb NSC274893 2825
Systematic (IUPAC) name
N/A
Identifiers
CAS number	?
ATC code	?
PubChem	5458548
Chemical data
Formula	C₄₀H₄₅ClN₂O₇
Mol. mass	701.2475
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

[edit] Description

N/A

Unknown

*Molecular Weight

701.2475

*Exact Mass

700.29153

*Molecular Formula

C₄₀H₄₅ClN₂O₇

*IUPAC NAME

N/A

*Canonical Smiles

C[NH+]1CCC2=CC(=C(C3=C2C1CC4=C(C=CC(=C43)OC)OC5=C(C=C6C(=C5)CC7C8=C6C(=C(C=C8CCN7C)OC)OC)OC)OC)OC.[Cl-]

*Isomeric Smiles

N/A

*XLogP

N/A

*Hydrogen bond donor

1

*Hydrogen bond acceptor

9

*Rotational Bond Count

8

*Topological Polar Surface Area

72.3