Base information

Cat. No.
CAS No.69787-80-0
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C61H90Cl2O32
Molecular Weight 1406.25
Exact Mass 1404.48
XLogP3 0.8438
Mr 315.347
PSA 388.04
Sequence -
Atom number 185
Bond number 195
Ring number 11
Rotor number 20
Residues number 0
Canonical smiles COC[C@H]1O[C@@H](O[C@@H]2OC[C@H]3[C@H]([C@H]2OC(=O)C(C)C)O[C@@]2(O3)O[C@H](C)[C@@]([C@H]3[C@H]2OCO3)(O)[C@@H](O)C)[C@H]([C@H]([C@@H]1O[C@@H]1O[C@H](C)[C@@H]([C@@H]([C@H]1O)O[C@@H]1O[C@H](C)[C@@H]2[C@](C1)(C)OC1(O2)C[C@@H](O)[C@@H]([C@H](O1)C)O[C@H]1C[C@@H](O)[C@@H]([C@H](O1)C)OC(=O)c1c(C)c(Cl)c(c(c1OC)Cl)O)OC)O)OC

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