Base information

Cat. No.
CAS No.121377-67-1
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C39H57N9O9
Molecular Weight 795.925
Exact Mass 795.428
XLogP3 3.7799
Mr 210.946
PSA 290.59
Sequence -
Atom number 114
Bond number 116
Ring number 3
Rotor number 28
Residues number 0
Canonical smiles CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)[C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)N)CC(C)C)CC(=O)O)C

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