BIAdb Erben 2096

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BIAdb Erben 2096
Systematic (IUPAC) name
N/A
Identifiers
CAS number	?
ATC code	?
PubChem	11954335
Chemical data
Formula	C40H38N2O13S
Mol. mass	786.80032
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

786.80032

*Exact Mass

786.20946

*Molecular Formula

C₄₀H₃₈N₂O₁₃S

*IUPAC NAME

N/A

*Canonical Smiles

COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.O.[O-]S(=O)(=O)[O-]

*Isomeric Smiles

N/A

*XLogP

N/A

*Hydrogen bond donor

1

*Hydrogen bond acceptor

13

*Rotational Bond Count

4

*Topological Polar Surface Area

163

[edit] External Links

• Pubchem

• KEGG

Link to BIAdb Database