Base information

Cat. No.
CAS No.160187-72-4
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C50H91N21O12
Molecular Weight 1178.39
Exact Mass 1177.72
XLogP3 1.9414
Mr 310.663
PSA 562.45
Sequence -
Atom number 174
Bond number 175
Ring number 2
Rotor number 50
Residues number 0
Canonical smiles NCCCC[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)N)CCCNC(=N)N)CCCNC(=N)N)CCC(=O)N

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