Base information

Cat. No.
CAS No.144449-86-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C41H57N11O17
Molecular Weight 975.955
Exact Mass 975.393
XLogP3 -2.5646
Mr 235.336
PSA 451.3
Sequence -
Atom number 126
Bond number 128
Ring number 3
Rotor number 35
Residues number 0
Canonical smiles OC[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)NC(=O)[C@H](Cc1nc[nH]c1)NC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)N)C)CC(=O)O

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