Base information

Cat. No.
CAS No.136552-23-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C53H86O22
Molecular Weight 1075.24
Exact Mass 1074.56
XLogP3 -1.3978
Mr 260.106
PSA 353.9
Sequence -
Atom number 161
Bond number 169
Ring number 9
Rotor number 11
Residues number 0
Canonical smiles OC[C@H]1O[C@@H](O[C@H]2[C@@H](OC[C@H]([C@@H]2O)O)O[C@H]2CC[C@]3([C@H](C2(C)C)CC[C@@]2([C@@H]3CC=C3[C@@]2(C)CC[C@@]2([C@H]3[C@](C)(O)[C@H](CC2)C)C(=O)O[C@@H]2O[C@H](CO)[C@H]([C@@H]([C@H]2O)O)O)C)C)[C@@H]([C@H]([C@@H]1O)O)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O

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