Base information

Cat. No.
CAS No.114915-19-4
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C32H37Cl3O12
Molecular Weight 719.988
Exact Mass 718.135
XLogP3 3.6129
Mr 166.956
PSA 175.12
Sequence -
Atom number 84
Bond number 88
Ring number 5
Rotor number 10
Residues number 0
Canonical smiles O=C(O[C@H]1C[C@H]2OC[C@]2([C@@H]2[C@]1(C)C(=O)[C@H](O)C1=C(C)[C@H](C[C@@]([C@H]2OC(=O)c2ccccc2)(C1(C)C)O)O)OC(=O)C)OCC(Cl)(Cl)Cl

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