Base information

Cat. No.
CAS No.132996-61-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C68H110N22O18
Molecular Weight 1523.74
Exact Mass 1522.84
XLogP3 2.3957
Mr 390.78
PSA 674.99
Sequence -
Atom number 218
Bond number 219
Ring number 2
Rotor number 66
Residues number 0
Canonical smiles NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)NCC(=O)O)Cc1ccccc1)Cc1ccc(cc1)O)CC(C)C)[C@H](O)C)CCCNC(=N)N)CCC(=O)N)CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](N)C)CC(C)C

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