Base information

Cat. No.
CAS No.210108-89-7
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C41H49NO14
Molecular Weight 779.826
Exact Mass 779.315
XLogP3 3.8497
Mr 198.21
PSA 211.15
Sequence -
Atom number 105
Bond number 108
Ring number 4
Rotor number 14
Residues number 0
Canonical smiles CC(=O)O[C@H]1C(=C)[C@H](OC(=O)C)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](C[C@]2(O)[C@@H](OC(=O)C)[C@H](/C=C/C([C@@H]([C@@H]1O)OC(=O)c1cccnc1)(C)C)C)(C)OC(=O)C

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