Base information

Cat. No.
CAS No.33515-09-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C55H75N17O13
Molecular Weight 1182.29
Exact Mass 1181.57
XLogP3 1.1074
Mr 311.149
PSA 472.13
Sequence -
Atom number 160
Bond number 165
Ring number 6
Rotor number 41
Residues number 0
Canonical smiles OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N)CCCNC(=N)N)CC(C)C)Cc1ccc(cc1)O)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1)Cc1nc[nH]c1

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