Base information

Cat. No.
CAS No.100513-53-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C58H107NO23
Molecular Weight 1186.46
Exact Mass 1185.72
XLogP3 -1.4704
Mr 307.724
PSA 451.21
Sequence -
Atom number 189
Bond number 190
Ring number 2
Rotor number 40
Residues number 0
Canonical smiles CCCCCCCCCC[C@H](C[C@]1(O)O[C@H](C[C@@H]([C@H]([C@@H]([C@H]([C@H](C[C@H](C[C@H](C[C@H](C[C@H]([C@@H]([C@H]([C@H]([C@H](C[C@H]([C@@H]([C@H]([C@@H](C[C@@H](C[C@@H](/C=C(/C(=C/2\C(=O)CN(C2=O)C)/O)\C)C)C)O)O)C)O)O)C)O)C)O)O)O)O)O)O)O)O)O)[C@H]([C@@H]([C@@H]1O)O)O)O

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