Base information

Cat. No.
CAS No.70937-97-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C64H95N17O17
Molecular Weight 1374.54
Exact Mass 1373.71
XLogP3 3.8594
Mr 358.693
PSA 539.75
Sequence -
Atom number 193
Bond number 195
Ring number 5
Rotor number 47
Residues number 0
Canonical smiles CC(=O)O.CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)Cc1c[nH]cn1)Cc1ccccc1)Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)N)CCCNC(=N)N)C.O

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