Base information

Cat. No.
CAS No.86029-43-8
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C34H57N2O4+
Molecular Weight 557.827
Exact Mass 557.432
XLogP3 5.8626
Mr 169.597
PSA 55.84
Sequence -
Atom number 97
Bond number 102
Ring number 6
Rotor number 6
Residues number 0
Canonical smiles CC(=O)O[C@H]1C[C@@H]2CC[C@@H]3[C@@H]([C@]2(C[C@@H]1N1CCCCC1)C)CC[C@]1([C@H]3C[C@@H]([C@@H]1OC(=O)C)[N+]1(C)CCCCC1)C

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