Base information

Cat. No.
CAS No.143257-74-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C87H133N25O26S
Molecular Weight 1977.2
Exact Mass 1975.96
XLogP3 1.597
Mr 494.984
PSA 881.41
Sequence -
Atom number 272
Bond number 274
Ring number 3
Rotor number 79
Residues number 0
Canonical smiles CC[C@@H]([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[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)C(C)C)Cc1ccccc1)CCC(=O)N)CC(=O)N)CCC(=O)N)Cc1ccc(cc1)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](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CS)N)CC(=O)N)CC(C)C)C)C)C)C)CO)Cc1nc[nH]c1)C

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