Base information

Cat. No.
CAS No.84331-34-0
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C51H53ClO28
Molecular Weight 1149.4
Exact Mass 1148.24
XLogP3 -4.6112
Mr 267.205
PSA 465.03
Sequence -
Atom number 133
Bond number 139
Ring number 8
Rotor number 18
Residues number 0
Canonical smiles OC[C@H]1O[C@@H](Oc2cc3c(cc(cc3[o+]c2c2cc(O)c(c(c2)O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(c(c3)O)O)[C@H]([C@@H]([C@H]2O)O)O)O)O)O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(c(c3)O)O)[C@H]([C@@H]([C@H]2O)O)O)[C@@H]([C@H]([C@@H]1O)O)O.[Cl-]

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