Base information

Cat. No.
CAS No.401913-57-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C33H59N9O9
Molecular Weight 725.876
Exact Mass 725.444
XLogP3 1.943
Mr 190.745
PSA 298.24
Sequence -
Atom number 110
Bond number 110
Ring number 1
Rotor number 28
Residues number 0
Canonical smiles NCCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H](N)C)C)CCC(=O)N

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