Base information

Cat. No.
CAS No.167906-74-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C32H44O13
Molecular Weight 636.684
Exact Mass 636.278
XLogP3 3.167
Mr 158.9
PSA 178.03
Sequence -
Atom number 89
Bond number 90
Ring number 2
Rotor number 13
Residues number 0
Canonical smiles CC(=O)OC/C/1=C/[C@H](OC(=O)C)[C@@H]2C[C@H](OC(=O)C)C(=C(C2(C)C)[C@H](/C(=C(\[C@H](C[C@@H]1O)OC(=O)C)/C)/OC(=O)C)OC(=O)C)C

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