Base information

Cat. No.
CAS No.162088-92-8
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C26H31NO16
Molecular Weight 613.521
Exact Mass 613.164
XLogP3 1.2531
Mr 138.541
PSA 214.24
Sequence -
Atom number 74
Bond number 76
Ring number 3
Rotor number 15
Residues number 0
Canonical smiles CC(=O)O[C@H]1[C@@H](CO[C@H]([C@@H]1OC(=O)C)Oc1ccccc1[N+](=O)[O-])O[C@@H]1OC[C@H]([C@@H]([C@H]1OC(=O)C)OC(=O)C)OC(=O)C

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