BIAdb CID25021300 1748

BIAdb CID25021300 1748
Systematic (IUPAC) name
N/A
Identifiers
CAS number	?
ATC code	?
PubChem	25021300
Chemical data
Formula	C₄₀H₆₂N₂O₁₂S
Mol. mass	794.99148
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

[edit] Description

N/A

Unknown

*Molecular Weight

794.99148

*Exact Mass

794.402346

*Molecular Formula

C₄₀H₆₂N₂O₁₂S

*IUPAC NAME

N/A

*Canonical Smiles

COC1CCC2CC3C4CC5C(CC4CC[NH+]3CC2C1OC)OCO5.COC1=C(C2=C(CC1)CC3=[N+](C2)CCC4C3CC5C(C4)OCO5)OC.[O-]S(=O)(=O)[O-]

*Isomeric Smiles

N/A

*XLogP

N/A

*Hydrogen bond donor

1

*Hydrogen bond acceptor

12

*Rotational Bond Count

4

*Topological Polar Surface Area

162