Base information

Cat. No.
CAS No.75790-53-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C46H72N14O10
Molecular Weight 981.152
Exact Mass 980.556
XLogP3 3.6829
Mr 260.24
PSA 411.05
Sequence -
Atom number 142
Bond number 143
Ring number 2
Rotor number 40
Residues number 0
Canonical smiles CC[C@@H]([C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccc(cc1)O)N)CC(C)C)CCCNC(=N)N)CCCNC(=N)N)C

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