Base information

Cat. No.
CAS No.152074-97-0
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C92H141N25O26
Molecular Weight 2013.26
Exact Mass 2012.05
XLogP3 2.2175
Mr 517.646
PSA 829.18
Sequence -
Atom number 284
Bond number 288
Ring number 5
Rotor number 78
Residues number 0
Canonical smiles NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CCCNC(=N)N)[C@H](O)C)C(C)C)[C@H](CC)C)CC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)N)CCC(=O)O)CC(=O)N)Cc1cnc[nH]1)Cc1ccccc1)Cc1ccccc1

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