Base information

Cat. No.
CAS No.16727-30-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C29H35ClO17
Molecular Weight 691.031
Exact Mass 690.156
XLogP3 -4.8293
Mr 157.23
PSA 270.82
Sequence -
Atom number 82
Bond number 85
Ring number 5
Rotor number 9
Residues number 0
Canonical smiles OC[C@H]1O[C@@H](Oc2cc(O)cc3c2cc(O[C@@H]2O[C@H](CO)[C@H]([C@@H]([C@H]2O)O)O)c([o+]3)c2cc(OC)c(c(c2)OC)O)[C@@H]([C@H]([C@@H]1O)O)O.[Cl-]

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