Base information

Cat. No.
CAS No.153299-82-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C39H59N9O11
Molecular Weight 829.939
Exact Mass 829.433
XLogP3 1.6277
Mr 218.899
PSA 321.55
Sequence -
Atom number 118
Bond number 120
Ring number 3
Rotor number 30
Residues number 0
Canonical smiles NCCCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)Cc1ccccc1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)CCC(=O)N)CC(=O)O

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