Base information

Cat. No.
CAS No.146397-17-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C35H44N2O10S2
Molecular Weight 716.861
Exact Mass 716.244
XLogP3 7.9269
Mr 193.962
PSA 209.18
Sequence -
Atom number 93
Bond number 96
Ring number 4
Rotor number 16
Residues number 0
Canonical smiles OC(=O)CCCCCN1c2ccc(cc2C(/C/1=C/C=C/C1=[N+](CCCCCC(=O)O)c2c(C1(C)C)cc(cc2)S(=O)(=O)O)(C)C)S(=O)(=O)[O-]

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