Base information

Cat. No.
CAS No.131929-68-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C33H50O9
Molecular Weight 590.745
Exact Mass 590.345
XLogP3 4.0079
Mr 157.299
PSA 109.75
Sequence -
Atom number 92
Bond number 96
Ring number 5
Rotor number 6
Residues number 0
Canonical smiles CO[C@H]1[C@H](O[C@@H]2C[C@@H]3[C@@H](C2)[C@@H]2C=C4[C@H]([C@@H]2C=C3)CC(=O)O[C@@H](CC)CCC[C@@H]([C@H](C4=O)C)O)O[C@H]([C@@H]([C@H]1OC)OC)C

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