Base information

Cat. No.
CAS No.67224-41-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C50H71N15O11S
Molecular Weight 1090.26
Exact Mass 1089.52
XLogP3 3.6938
Mr 284.87
PSA 462.01
Sequence -
Atom number 148
Bond number 151
Ring number 4
Rotor number 43
Residues number 0
Canonical smiles NCCCC[C@@H](C(=O)O)NC(=O)CNC(=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](CCSC)N)CCC(=O)O)Cc1nc[nH]c1)Cc1ccccc1)CCCNC(=N)N

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