Base information

Cat. No.
CAS No.134248-85-4
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C147H243N41O31
Molecular Weight 3080.76
Exact Mass 3078.87
XLogP3 9.9571
Mr 812.631
PSA 1259.87
Sequence -
Atom number 462
Bond number 466
Ring number 5
Rotor number 144
Residues number 0
Canonical smiles NCCCC[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[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)O)CCCCN)CCCCN)CC(=O)N)CCCCN)CCCCN)Cc1ccccc1)CO)Cc1ccccc1)CO)CC(C)C)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)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)N)CCCCN)CCCCN)CCCCN)CCCCN)CCCNC(=N)N)Cc1ccccc1)CO)Cc1ccccc1)CCCCN)CCCCN)CO)Cc1ccccc1

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