Base information

Cat. No.
CAS No.12569-38-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C18H34CaO20
Molecular Weight 610.529
Exact Mass 610.127
XLogP3 -9.3805
Mr 109.417
PSA 343.28
Sequence -
Atom number 73
Bond number 72
Ring number 1
Rotor number 15
Residues number 0
Canonical smiles OC[C@H]([C@H]([C@@H]([C@H](C(=O)O[Ca]OC(=O)[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)O)O)O[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O)O.O

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