Base information

Cat. No.
CAS No.102068-15-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C88H162N26O22S
Molecular Weight 1968.45
Exact Mass 1967.21
XLogP3 4.6501
Mr 510.361
PSA 800.72
Sequence -
Atom number 299
Bond number 298
Ring number 0
Rotor number 90
Residues number 0
Canonical smiles NCCCC[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)N[C@H](C(=O)N[C@H](C(=O)N)CC(C)C)C)CCCCN)CC(C)C)C)C(C)C)CCCCN)C)[C@H](CC)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CN)CCSC)C)CO)CCCCN)C)C)C

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