Base information

Cat. No.
CAS No.121379-63-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C42H62N10O12
Molecular Weight 899.001
Exact Mass 898.455
XLogP3 1.66
Mr 233.046
PSA 344.44
Sequence -
Atom number 126
Bond number 128
Ring number 3
Rotor number 31
Residues number 0
Canonical smiles O=C(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)O)C(C)C)Cc1nc[nH]c1)C(C)C)Cc1ccc(cc1)O)C(C)C)CNC(=O)[C@H](CCC(=O)O)N

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