Base information

Cat. No.
CAS No.173606-11-6
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C51H68N10O11S2
Molecular Weight 1061.28
Exact Mass 1060.45
XLogP3 2.889
Mr 299.298
PSA 385.9
Sequence -
Atom number 142
Bond number 146
Ring number 5
Rotor number 21
Residues number 0
Canonical smiles OC[C@H]([C@H](O)C)NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](Cc2ccccc2)N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)[C@H](O)C)CCCCNC(=O)C)Cc1c[nH]c2c1cccc2

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