Base information

Cat. No.
CAS No.1198367-70-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C164H285N65O41
Molecular Weight 3823.43
Exact Mass 3821.22
XLogP3 3.5885
Mr 998.916
PSA 1789.09
Sequence -
Atom number 555
Bond number 561
Ring number 7
Rotor number 165
Residues number 0
Canonical smiles NCCCC[C@H](C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C(=O)N1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(=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)NCC(=O)O)CCCNC(=N)N)CCCCN)CCCCN)CCCNC(=N)N)CCCNC(=N)N)CCC(=O)N)CCCNC(=N)N)CCCNC(=N)N)CCCNC(=N)N)CCCNC(=N)N)NC(=O)[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H]([C@@H](O)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](NC(=O)[C@H]1CCCN1C(=O)[C@H](NC(=O)[C@@H](C(C)C)NC(=O)[C@H]1CCCN1C(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@@H](CC(=O)O)N)CCC(=O)N)CO)CCCNC(=N)N)CCC(=O)N)Cc1ccccc1)CC(C)C)CC(=O)N)CC(C)C)CCCNC(=N)N

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