Base information

Cat. No.
CAS No.173101-59-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C41H49NO13
Molecular Weight 763.827
Exact Mass 763.32
XLogP3 2.652
Mr 194.127
PSA 215.22
Sequence -
Atom number 104
Bond number 109
Ring number 6
Rotor number 13
Residues number 0
Canonical smiles CCC(=O)N[C@H]([C@H](C(=O)O[C@H]1C[C@@]2(O)[C@@H](OC(=O)c3ccccc3)[C@@H]3[C@@]4(CO[C@@H]4C[C@@H]([C@]3(C(=O)[C@@H](C(=C1C)C2(C)C)O)C)O)OC(=O)C)O)c1ccccc1

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