Base information

Cat. No.
CAS No.75410-52-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C41H65NaO16S
Molecular Weight 869
Exact Mass 868.389
XLogP3 3.0405
Mr 205.33
PSA 259.41
Sequence -
Atom number 124
Bond number 129
Ring number 7
Rotor number 10
Residues number 0
Canonical smiles CC(CCC[C@]1(C)OC(=O)[C@]23[C@]1(O)CC[C@@]3(C)[C@H]1C(=C[C@@H]2O)[C@@]2(C)CC[C@@H](C([C@@H]2CC1)(C)C)O[C@@H]1OC[C@H]([C@@H]([C@H]1O[C@@H]1O[C@H](C)[C@H]([C@@H]([C@H]1O)O)O)O)OS(=O)(=O)[O-])C.[Na+]

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