Base information

Cat. No.
CAS No.135575-42-7
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C50H80N8O17
Molecular Weight 1065.21
Exact Mass 1064.56
XLogP3 -1.0591
Mr 290.682
PSA 411.28
Sequence -
Atom number 155
Bond number 158
Ring number 4
Rotor number 21
Residues number 0
Canonical smiles CCC(CC(CCCCCCCCC(=O)N[C@H]1C[C@@H](O)[C@@H](O)NC(=O)[C@@H]2[C@@H](O)CCN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]2N(C(=O)[C@@H](NC1=O)[C@H](O)C)C[C@@H](C2)O)[C@@H]([C@H](c1ccc(cc1)O)O)O)[C@@H](CC(=O)N)O)C)C

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