Base information

Cat. No.
CAS No.87549-53-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C47H72N14O11
Molecular Weight 1009.16
Exact Mass 1008.55
XLogP3 2.4394
Mr 268.104
PSA 422.49
Sequence -
Atom number 144
Bond number 146
Ring number 3
Rotor number 38
Residues number 0
Canonical smiles OC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)C)CCCNC(=N)N)CC(C)C)CCCNC(=N)N)Cc1ccccc1)Cc1ccc(cc1)O

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