Base information

Cat. No.
CAS No.143370-84-7
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C46H64O17
Molecular Weight 888.99
Exact Mass 888.414
XLogP3 3.6422
Mr 224.179
PSA 240.11
Sequence -
Atom number 127
Bond number 131
Ring number 5
Rotor number 11
Residues number 0
Canonical smiles CCC/C=C/C=C/C(=O)O[C@H]1C2=CC(=O)O[C@@H]2[C@@H]2O[C@@]1(O)C(C)(C)/C=C\[C@H]1C/C(=C\C(=O)OC)/C[C@H](O1)C[C@]1(O)O[C@H](C[C@H](CC(=O)OC(C2)[C@H](O)C)O)C[C@@H](C1(C)C)OC(=O)C

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