Base information

Cat. No.
CAS No.208264-84-0
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C31H38N6O12
Molecular Weight 686.666
Exact Mass 686.255
XLogP3 2.596
Mr 173.356
PSA 286.15
Sequence -
Atom number 87
Bond number 88
Ring number 2
Rotor number 23
Residues number 0
Canonical smiles OC(=O)C[C@@H](C(=O)Nc1ccc(cc1)[N+](=O)[O-])NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)CCC(=O)O)C

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