Base information

Cat. No.
CAS No.74211-28-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C20H28N2O13
Molecular Weight 504.442
Exact Mass 504.159
XLogP3 -2.3444
Mr 113.247
PSA 233.22
Sequence -
Atom number 63
Bond number 65
Ring number 3
Rotor number 9
Residues number 0
Canonical smiles OC[C@H]1O[C@@H](Oc2ccc(cc2)[N+](=O)[O-])[C@@H]([C@H]([C@@H]1O[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O)O)NC(=O)C

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