Base information

Cat. No.
CAS No.66839-66-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C71H110N22O18S
Molecular Weight 1591.83
Exact Mass 1590.81
XLogP3 2.9739
Mr 409.263
PSA 675.55
Sequence -
Atom number 222
Bond number 225
Ring number 4
Rotor number 64
Residues number 0
Canonical smiles NCCCC[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)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCSC)CC(C)C)Cc1nc[nH]c1)C(C)C)C)Cc1c[nH]c2c1cccc2)CCC(=O)N)CC(=O)N)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1)CCC(=O)N

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