Base information

Cat. No.
CAS No.70572-93-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C90H134N30O24S
Molecular Weight 2052.28
Exact Mass 2050.99
XLogP3 1.3415
Mr 519.797
PSA 938.47
Sequence -
Atom number 279
Bond number 283
Ring number 5
Rotor number 82
Residues number 0
Canonical smiles CSCC[C@@H](C(=O)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)NC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CO)N)CC(=O)N)C)CC(C)C)CCCNC(=N)N)CCCNC(=N)N)Cc1ccc(cc1)O)CC(=O)N)CCC(=O)N)C)Cc1ccccc1

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