Base information

Cat. No.
CAS No.160040-04-0
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C53H83N11O19S
Molecular Weight 1210.35
Exact Mass 1209.56
XLogP3 0.8936
Mr 304.308
PSA 520.11
Sequence -
Atom number 167
Bond number 168
Ring number 2
Rotor number 46
Residues number 0
Canonical smiles CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)[C@H](O)C)CCC(=O)O)CCC(=O)N)CC(C)C)CC(=O)O)CC(C)C)NC(=O)[C@H](Cc1ccc(cc1)O)N

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