Base information

Cat. No.
CAS No.11050-94-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C45H72O12
Molecular Weight 805.046
Exact Mass 804.502
XLogP3 5.0616
Mr 220.605
PSA 197.12
Sequence -
Atom number 129
Bond number 131
Ring number 3
Rotor number 3
Residues number 0
Canonical smiles CC[C@H]1/C=C/C=C/C[C@@H](C)[C@H](O)[C@@](C)(O)C(=O)[C@@H](C)[C@H](O)[C@@H](C)C(=O)[C@H]([C@@H]([C@H](/C=C/C(=O)O[C@@H]2[C@@H]([C@H](CC1)O[C@@]1(O[C@@H](C[C@H](O)C)[C@H](CC1=O)C)[C@H]2C)C)C)O)C

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