Base information

Cat. No.
CAS No.165174-59-4
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C50H76N16O21S
Molecular Weight 1269.3
Exact Mass 1268.51
XLogP3 -3.6082
Mr 304.373
PSA 670.2
Sequence -
Atom number 164
Bond number 165
Ring number 2
Rotor number 49
Residues number 0
Canonical smiles SC[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)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CO)CO)CC(=O)O)CCC(=O)N)Cc1ccccc1)CCCN=C(N)N)CC(=O)O)CC(=O)O)NC(=O)[C@H]([C@H](O)C)N

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