Base information

Cat. No.
CAS No.28244-94-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C21H26O9S
Molecular Weight 454.491
Exact Mass 454.13
XLogP3 2.1702
Mr 109.731
PSA 139.73
Sequence -
Atom number 57
Bond number 58
Ring number 2
Rotor number 11
Residues number 0
Canonical smiles CC(=O)OC[C@H]1O[C@@H](Sc2ccc(cc2)C)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C

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