Base information

Cat. No.
CAS No.202801-92-1
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C126H215N45O34S
Molecular Weight 2936.4
Exact Mass 2934.62
XLogP3 2.0075
Mr 752.943
PSA 1303.8
Sequence -
Atom number 421
Bond number 424
Ring number 4
Rotor number 125
Residues number 0
Canonical smiles CSCC[C@@H](C(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)N)CC(C)C)CCC(=O)N)CCCNC(=N)N)CC(C)C)CCC(=O)N)CCCNC(=N)N)CC(C)C)CC(C)C)CCC(=O)N)C)CC(=O)N)Cc1nc[nH]c1)C)C)CC(C)C

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