Base information

Cat. No.
CAS No.156294-36-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C45H53NO14
Molecular Weight 831.901
Exact Mass 831.347
XLogP3 4.8604
Mr 211.715
PSA 210.29
Sequence -
Atom number 113
Bond number 119
Ring number 7
Rotor number 16
Residues number 0
Canonical smiles CC(=O)O[C@H]1C(=O)[C@]23C[C@H]2C[C@@H]2[C@]([C@H]3[C@@H]([C@]3(C(C1=C(C)[C@@H](OC(=O)[C@@H]([C@H](c1ccccc1)NC(=O)OC(C)(C)C)O)C3)(C)C)O)OC(=O)c1ccccc1)(CO2)OC(=O)C

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