Base information

Cat. No.
CAS No.290809-29-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C52H82O21
Molecular Weight 1043.19
Exact Mass 1042.53
XLogP3 -0.8386
Mr 253.626
PSA 333.67
Sequence -
Atom number 155
Bond number 163
Ring number 9
Rotor number 11
Residues number 0
Canonical smiles OC[C@H]1O[C@@H](O[C@H]2[C@H](O)CO[C@H]([C@@H]2O)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]3CC(=C)CC2)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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