Base information

Cat. No.
CAS No.185698-23-1
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C42H52N8O14
Molecular Weight 892.907
Exact Mass 892.36
XLogP3 4.8093
Mr 241.159
PSA 308.33
Sequence -
Atom number 116
Bond number 120
Ring number 5
Rotor number 26
Residues number 0
Canonical smiles COc1ccc2c(c1)oc(=O)cc2CC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](C(=O)O)CCCCNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])CC(C)C

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