Base information

Cat. No.
CAS No.1041631-93-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C36H56O8
Molecular Weight 616.825
Exact Mass 616.398
XLogP3 4.085
Mr 170.313
PSA 136.68
Sequence -
Atom number 100
Bond number 104
Ring number 5
Rotor number 8
Residues number 0
Canonical smiles OC[C@H]1O[C@@H](O[C@H]2C=C3[C@H]([C@]4([C@@H]2[C@]2(C)CC[C@@H]([C@@]2(C)CC4)[C@@H](C/C=C/C(=C)C)C)C=O)CC[C@@H](C3(C)C)O)[C@@H]([C@H]([C@@H]1O)O)O

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