Base information

Cat. No.
CAS No.34973-08-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C57H79N17O15
Molecular Weight 1242.34
Exact Mass 1241.59
XLogP3 1.1983
Mr 324.648
PSA 509.43
Sequence -
Atom number 168
Bond number 172
Ring number 6
Rotor number 41
Residues number 0
Canonical smiles CC(=O)O.OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N)CCCNC(=N)N)CC(C)C)Cc1ccc(cc1)O)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1)Cc1nc[nH]c1

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