Base information

Cat. No.
CAS No.1926163-25-8
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C61H86N16O13
Molecular Weight 1251.43
Exact Mass 1250.66
XLogP3 3.9272
Mr 337.206
PSA 435.11
Sequence -
Atom number 176
Bond number 181
Ring number 6
Rotor number 44
Residues number 0
Canonical smiles CCNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1)Cc1[nH]cnc1)COC(=O)C)Cc1ccc(cc1)O)CC(C)C)CC(C)C)CCCNC(=N)N

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