Base information

Cat. No.
CAS No.383417-46-7
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C18H25NO12
Molecular Weight 447.391
Exact Mass 447.138
XLogP3 -1.8515
Mr 100.631
PSA 204.12
Sequence -
Atom number 56
Bond number 58
Ring number 3
Rotor number 6
Residues number 0
Canonical smiles OC[C@H]1O[C@H](Oc2ccc(cc2)[N+](=O)[O-])[C@@H]([C@H]([C@H]1O)O)O[C@@H]1O[C@@H](C)[C@H]([C@H]([C@@H]1O)O)O

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