Base information

Cat. No.
CAS No.256639-17-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C101H171N27O24
Molecular Weight 2147.6
Exact Mass 2146.3
XLogP3 8.266
Mr 561.157
PSA 880.71
Sequence -
Atom number 323
Bond number 324
Ring number 2
Rotor number 99
Residues number 0
Canonical smiles NCCCC[C@@H](C(=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)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCCCN)CCC(=O)N)Cc1ccccc1)Cc1ccccc1)CC(=O)N)CCCCN)[C@H](CC)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CN)CCC(=O)O)CCCCN)CC(C)C)CCCCN)CCCCN)CCC(=O)N

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