Base information

Cat. No.
CAS No.859-18-7
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C18H35ClN2O6S
Molecular Weight 442.998
Exact Mass 442.19
XLogP3 0.2738
Mr 114.513
PSA 147.79
Sequence -
Atom number 63
Bond number 63
Ring number 2
Rotor number 8
Residues number 0
Canonical smiles CCC[C@H]1CN([C@@H](C1)C(=O)N[C@@H]([C@H]1O[C@H](SC)[C@@H]([C@H]([C@H]1O)O)O)[C@H](O)C)C.Cl

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