Base information

Cat. No.
CAS No.126266-38-4
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C31H46ClNO11
Molecular Weight 644.15
Exact Mass 643.276
XLogP3 0.5069
Mr 161.003
PSA 156.61
Sequence -
Atom number 90
Bond number 94
Ring number 7
Rotor number 8
Residues number 0
Canonical smiles COC[C@@]12CN(C)C3[C@]4([C@@H]2[C@@H](OC)[C@@H]3[C@@]2([C@]3([C@H]4C[C@@]([C@@H]3OC(=O)c3ccccc3)([C@H](C2)OC)O)O)O)[C@H](C[C@H]1O)OC.Cl.O

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