Base information

Cat. No.
CAS No.86303-25-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C28H45N6O17P3S
Molecular Weight 862.673
Exact Mass 862.177
XLogP3 1.4995
Mr 201.037
PSA 398.2
Sequence -
Atom number 100
Bond number 103
Ring number 4
Rotor number 24
Residues number 0
Canonical smiles O=C(NC/C=C/c1cn([C@H]2C[C@@H]([C@H](O2)COP(=O)(OP(=O)(OP(=O)(O)O)O)O)O)c(=O)[nH]c1=O)CCCCCNC(=O)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2

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