Base information

Cat. No.
CAS No.133950-47-7
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C103H175N35O27S
Molecular Weight 2367.77
Exact Mass 2366.31
XLogP3 2.2435
Mr 606.049
PSA 1062.1
Sequence -
Atom number 341
Bond number 343
Ring number 3
Rotor number 102
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)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCSC)CC(C)C)C(C)C)Cc1ccccc1)CO)CC(=O)N)[C@H](CC)C)CCCCN)Cc1nc[nH]c1)CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)N)C)CC(=O)N)C)CCC(=O)N)CCCNC(=N)N

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