Base information

Cat. No.
CAS No.141281-67-6
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C73H126N20O23S
Molecular Weight 1683.97
Exact Mass 1682.9
XLogP3 0.4659
Mr 429.669
PSA 723.03
Sequence -
Atom number 243
Bond number 244
Ring number 2
Rotor number 68
Residues number 0
Canonical smiles NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=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)C)CC(C)C)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)C)CC(=O)N)CC(=O)O)CS)CCCCN)CC(C)C

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