Base information

Cat. No.
CAS No.796073-70-6
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C38H54ClN3O10S2
Molecular Weight 812.432
Exact Mass 811.294
XLogP3 6.0882
Mr 218.92
PSA 207.07
Sequence -
Atom number 108
Bond number 111
Ring number 4
Rotor number 12
Residues number 0
Canonical smiles CSSC(CCC(=O)N([C@H](C(=O)O[C@H]1CC(=O)N(C)c2cc(C/C(=C/C=C/[C@H]([C@]3(C[C@@H]([C@H]([C@H]4[C@@]1(C)O4)C)OC(=O)N3)O)OC)/C)cc(c2Cl)OC)C)C)C

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