Base information

Cat. No.
CAS No.12678-07-8
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C42H57N3Na6O43S3
Molecular Weight 1526.03
Exact Mass 1525.09
XLogP3 -13.5504
Mr 251.573
PSA 734.18
Sequence -
Atom number 156
Bond number 155
Ring number 6
Rotor number 30
Residues number 0
Canonical smiles *O[C@@H]1O[C@H](C(=O)[O-])[C@H]([C@@H]([C@H]1O)O)O[C@@H]1O[C@H](COS(=O)(=O)[O-])[C@H]([C@@H]([C@H]1NC(=O)C)O[C@@H]1O[C@H](C(=O)[O-])[C@H]([C@@H]([C@H]1O)O)O[C@@H]1O[C@H](COS(=O)(=O)[O-])[C@H]([C@@H]([C@H]1NC(=O)C)O[C@@H]1O[C@H](C(=O)[O-])[C@H]([C@@H]([C@H]1O)O)O[C@@H]1O[C@H](COS(=O)(=O)[O-])[C@H]([C@@H]([C@H]1NC(=O)C)O*)O)O)O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]

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