Base information

Cat. No.
CAS No.30892-86-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C56H91N15O13
Molecular Weight 1182.41
Exact Mass 1181.69
XLogP3 1.7085
Mr 329.181
PSA 401.37
Sequence -
Atom number 175
Bond number 180
Ring number 6
Rotor number 39
Residues number 0
Canonical smiles NCCCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O)[C@H](CC)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCC(=O)N1)CC(C)C)CCCNC(=N)N

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