Base information

Cat. No.
CAS No.185461-45-4
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C43H75N13O9
Molecular Weight 918.137
Exact Mass 917.581
XLogP3 3.0787
Mr 247.607
PSA 334.82
Sequence -
Atom number 140
Bond number 141
Ring number 2
Rotor number 36
Residues number 0
Canonical smiles CNCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@H](CC)C)C(=O)O)Cc1nc[nH]c1)[C@H](CC)C)[C@H](CC)C)C(C)C)CCCNC(=N)N

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